Geometry & MOs

Info

ID:	217148
PubChem CID:	85087327
Reduced:	O5C19H28 (1)
Stoich.:	A5B19C28 (1)
Weight, g/mol:	336.183778
ΔH_f, kcal/mol:	-239.77
Dipole, Da:	5.25
IP(EA), eV:	-9.85(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-amino-5-(3-methoxyphenyl)-1-phenyl-3-(propan-2-ylamino)penta-2,4-dien-1-one

Drug info:

PubChemData

Smile

CC1CC(CC(C1=CC(=O)C(=CCOC(=O)C)C)(C)C)OC(=O)C

DOS

IR

Vibrations