Geometry & MOs

Info

ID:	311505
PubChem CID:	126592974
Reduced:	O2N3C9H9 (1)
Stoich.:	A2B3C9D9 (1)
Weight, g/mol:	177.090212
ΔH_f, kcal/mol:	51.55
Dipole, Da:	8.0
IP(EA), eV:	-9.4(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-aminoethenyl)-3-methyl-4-methylidenepyrrole-2-carboxamide

Drug info:

PubChemData

Smile

C1=CC(=CC=C1/C(=C/N)/C=N)[N+](=O)[O-]

DOS

IR

Vibrations