Geometry & MOs

Info

ID:	390800
PubChem CID:	135000998
Reduced:	OC13H17 (2)
Stoich.:	AB13C17 (2)
Weight, g/mol:	494.166414
ΔH_f, kcal/mol:	-72.34
Dipole, Da:	2.06
IP(EA), eV:	-8.91(0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,3-diphenylprop-2-ynyl)-N-[(E)-(4-methoxyphenyl)methylideneamino]-4-methylbenzenesulfonamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1)C(C)(C)C)OC(=O)[C@H]2C[C@@H]2CC3=CC=CC=C3)C(C)(C)C

DOS

IR

Vibrations