Geometry & MOs

Info

ID:	1238
PubChem CID:	4030
Reduced:	N3O3H13C16 (1)
Stoich.:	A3B3C13D16 (1)
Weight, g/mol:	295.095691
ΔH_f, kcal/mol:	-40.4
Dipole, Da:	3.27
IP(EA), eV:	-9.13(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-(6-benzoyl-1H-benzimidazol-2-yl)carbamate

Drug info:

PubChemData

Smile

COC(=O)NC1=NC2=C(N1)C=C(C=C2)C(=O)C3=CC=CC=C3

DOS

IR

Vibrations