Geometry & MOs

Info

ID:	290022
PubChem CID:	104397817
Reduced:	ClON2C14H23 (1)
Stoich.:	ABC2D14E23 (1)
Weight, g/mol:	277.124883
ΔH_f, kcal/mol:	-44.0
Dipole, Da:	1.56
IP(EA), eV:	-8.97(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-cyano-3-methylsulfanylanilino)-N-propan-2-ylpropanamide

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1)Cl)CNC(C)CNCCOC

DOS

IR

Vibrations