Geometry & MOs

Info

ID:

362080

PubChem CID:

127305700

Reduced:

O2N4C21H32 (1)

Stoich.:

A2B4C21D32 (1)

Weight, g/mol:

379.225977

ΔHf, kcal/mol:

-81.66

Dipole, Da:

5.36

IP(EA), eV:

-9.19(0.34)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

pyrrolidin-1-yl-[1-(6,7,8,9-tetrahydro-5H-carbazole-3-carbonyl)piperidin-3-yl]methanone

Drug info:

PubChemData

Smile

CN1C=C(C(=N1)C2CCCCC2)C(=O)N3CCCC(C3)C(=O)N4CCCC4

DOS

IR

Vibrations