Geometry & MOs

Info

ID:	189466
PubChem CID:	77861824
Reduced:	N5O5H23C24 (1)
Stoich.:	A5B5C23D24 (1)
Weight, g/mol:	204.053492
ΔH_f, kcal/mol:	-115.76
Dipole, Da:	5.99
IP(EA), eV:	-8.95(-1.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 7-methylidene-2-oxo-3H-benzimidazole-5-carboxylate

Drug info:

PubChemData

Smile

CC1=CC(=CC2=C1NC(=O)O2)C(=O)C3CC3C(=O)N4CCC(CC4)N5C6=C(NC5=O)N=CC=C6

DOS

IR

Vibrations