Geometry & MOs

Info

ID:	404110
PubChem CID:	135064977
Reduced:	NO2C17H21 (1)
Stoich.:	AB2C17D21 (1)
Weight, g/mol:	442.03071
ΔH_f, kcal/mol:	-50.54
Dipole, Da:	5.57
IP(EA), eV:	-9.55(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-[(2-iodophenyl)-phenyl-(propan-2-ylamino)-lambda5-phosphanylidene]carbamate

Drug info:

PubChemData

Smile

CCC1(CCCN(C1=O)CC2=CC=CC=C2)/C=C/C=O

DOS

IR

Vibrations