Geometry & MOs

Info

ID:	449271
PubChem CID:	135297290
Reduced:	NO2H39C41 (1)
Stoich.:	AB2C39D41 (1)
Weight, g/mol:	362.06701
ΔH_f, kcal/mol:	34.22
Dipole, Da:	1.31
IP(EA), eV:	-7.73(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(Z)-2-(4-bromophenyl)-1-phenylethenyl]-1,2-dimethylbenzene

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)/C(=C/C2=CC=C(C=C2)N(C3=CC=C(C=C3)C)C4=CC=C(C=C4)CCCOC(=O)C(=C)C)/C5=CC=CC=C5

DOS

IR

Vibrations