Geometry & MOs

Info

ID:	50426
PubChem CID:	12012959
Reduced:	PN3O4C14H20 (1)
Stoich.:	AB3C4D14E20 (1)
Weight, g/mol:	326.114392
ΔH_f, kcal/mol:	-199.59
Dipole, Da:	3.79
IP(EA), eV:	-9.14(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(diethoxyphosphorylmethyl)benzimidazole-1-carbohydrazide

Drug info:

PubChemData

Smile

CC(C)NC(=O)N1C2=CC=CC=C2N=C1CP(=O)(OC)OC

DOS

IR

Vibrations