Geometry & MOs

Info

ID:

163218

PubChem CID:

57654893

Reduced:

C2P2H7 (2)

Stoich.:

A2B2C7 (2)

Weight, g/mol:

1120.638299

ΔHf, kcal/mol:

-53.5

Dipole, Da:

3.12

IP(EA), eV:

-8.2(1.66)

Spin(Sz, S2):

None, None

Charge, e:

2

Chem-info

IUPAC name:

2'-[(E,3E)-3-[3-benzyl-1-[[4-[[(2E)-3-benzyl-3-methyl-2-[(E)-3-(1'-methylspiro[cyclohexane-1,3'-indol-1-ium]-2'-yl)prop-2-enylidene]benzo[g]indol-1-yl]methyl]phenyl]methyl]-3-methylbenzo[g]indol-2-ylidene]prop-1-enyl]-1'-methylspiro[cyclohexane-1,3'-indol-1-ium]

Drug info:

PubChemData

Smile

CC(C)(C)P(P)PP

DOS

IR

Vibrations