Geometry & MOs

Info

ID:	13747
PubChem CID:	397478
Reduced:	NOSC23H27 (1)
Stoich.:	ABCD23E27 (1)
Weight, g/mol:	365.181336
ΔH_f, kcal/mol:	11.0
Dipole, Da:	2.97
IP(EA), eV:	-8.65(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-tert-butyl-N-(2-methyl-3-phenylprop-2-enyl)-3-phenylsulfanylprop-2-enamide

Drug info:

PubChemData

Smile

CC(=CC1=CC=CC=C1)CN(C(=O)C=CSC2=CC=CC=C2)C(C)(C)C

DOS

IR

Vibrations