Geometry & MOs

Info

ID:	50424
PubChem CID:	12012957
Reduced:	PN3O4C16H24 (1)
Stoich.:	AB3C4D16E24 (1)
Weight, g/mol:	311.103493
ΔH_f, kcal/mol:	-210.17
Dipole, Da:	5.39
IP(EA), eV:	-9.07(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(dimethoxyphosphorylmethyl)-N-ethylbenzimidazole-1-carboxamide

Drug info:

PubChemData

Smile

CCCNC(=O)N1C2=CC=CC=C2N=C1CP(=O)(OCC)OCC

DOS

IR

Vibrations