Geometry & MOs

Info

ID:	397803
PubChem CID:	135030749
Reduced:	BrNH26C34 (1)
Stoich.:	ABC26D34 (1)
Weight, g/mol:	403.05718
ΔH_f, kcal/mol:	163.96
Dipole, Da:	3.64
IP(EA), eV:	-8.16(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4R)-4-(2-bromoanilino)-5,5-diphenylcyclopent-2-en-1-one

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)C3=C(N2)C4C=CC(=C(C5=CC=CC=C5)C6=CC=CC=C6)C4C3C7=CC=C(C=C7)Br

DOS

IR

Vibrations