Geometry & MOs

Info

ID:

248925

PubChem CID:

103085565

Reduced:

N5C16H25 (1)

Stoich.:

A5B16C25 (1)

Weight, g/mol:

253.113902

ΔHf, kcal/mol:

59.42

Dipole, Da:

6.11

IP(EA), eV:

-9.46(-0.25)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

1-[1-[(2,4-difluorophenyl)methyl]tetrazol-5-yl]-N-methylethanamine

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)CCN2C(=NN=N2)C(C)NCC(C)C

DOS

IR

Vibrations