Geometry & MOs

Info

ID:	401030
PubChem CID:	135049818
Reduced:	SO2N3C16H25 (1)
Stoich.:	AB2C3D16E25 (1)
Weight, g/mol:	513.198829
ΔH_f, kcal/mol:	-65.32
Dipole, Da:	6.74
IP(EA), eV:	-8.43(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[[chloro(triphenyl)-lambda5-phosphanyl]methyl]phenyl]cyclohexanecarboxamide

Drug info:

PubChemData

Smile

CCCC1=CN=C(C(=N1)S(=O)CC(=O)N2CCCC2)CCC

DOS

IR

Vibrations