Geometry & MOs

Info

ID:	383139
PubChem CID:	134974700
Reduced:	NOSC19H23 (1)
Stoich.:	ABCD19E23 (1)
Weight, g/mol:	393.194008
ΔH_f, kcal/mol:	-25.58
Dipole, Da:	2.57
IP(EA), eV:	-8.75(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (E)-2-benzoyl-3-(diethylamino)-5-oxo-5-phenylpent-2-enoate

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)CCC2=CC(=C(C=C2)C)SC(=O)N(C)C

DOS

IR

Vibrations