Geometry & MOs

Info

ID:	228421
PubChem CID:	87564338
Reduced:	N4O4C25H30 (1)
Stoich.:	A4B4C25D30 (1)
Weight, g/mol:	267.090342
ΔH_f, kcal/mol:	-108.69
Dipole, Da:	5.33
IP(EA), eV:	-8.51(-1.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

chloro-N-[2-cyano-2-[di(propan-2-yl)amino]ethyl]phosphonamidic acid

Drug info:

PubChemData

Smile

CN(C)CC(=O)N(C)C1=CC=C(C=C1)NCCC/C=C/2\C3=C(C=C(C=C3)C(=O)OC)NC2=O

DOS

IR

Vibrations