Geometry & MOs

Info

ID:	411448
PubChem CID:	135084279
Reduced:	BClPO2C5H12 (1)
Stoich.:	ABCD2E5F12 (1)
Weight, g/mol:	225.126598
ΔH_f, kcal/mol:	-8.33
Dipole, Da:	4.29
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.754197
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-N'-(2-methylpyridin-3-yl)-N-phenylmethanimidamide

Drug info:

PubChemData

Smile

[B][P+](CCl)(OCC)OCC

DOS

IR

Vibrations