Geometry & MOs

Info

ID:	123567
PubChem CID:	50854316
Reduced:	N3C16H19 (1)
Stoich.:	A3B16C19 (1)
Weight, g/mol:	374.210661
ΔH_f, kcal/mol:	67.08
Dipole, Da:	6.14
IP(EA), eV:	-7.95(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(Z)-(1-cyclopentylpyrrol-3-yl)methylideneamino]-3-(2,5-dimethylpyrrol-1-yl)benzamide

Drug info:

PubChemData

Smile

C1CCC(C1)N2C=CC(=C2)/C=N\NC3=CC=CC=C3

DOS

IR

Vibrations