Geometry & MOs

Info

ID:	424495
PubChem CID:	135122903
Reduced:	NO2P2C8H21 (1)
Stoich.:	AB2C2D8E21 (1)
Weight, g/mol:	218.105528
ΔH_f, kcal/mol:	-62.63
Dipole, Da:	2.88
IP(EA), eV:	-8.57(1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

propyl 3-methylbenzimidazole-5-carboxylate

Drug info:

PubChemData

Smile

CCN(OCC(C)P)OCC(C)P

DOS

IR

Vibrations