Geometry & MOs

Info

ID:	443397
PubChem CID:	135258857
Reduced:	NC18H19 (1)
Stoich.:	AB18C19 (1)
Weight, g/mol:	778.2654
ΔH_f, kcal/mol:	48.53
Dipole, Da:	1.59
IP(EA), eV:	-7.91(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-[5-[4-[4-(N-phenylanilino)benzoyl]phenyl]thiophen-2-yl]phenyl]-[4-(N-phenylanilino)phenyl]methanone

Drug info:

PubChemData

Smile

CC(C)C1=C2C=CC=CC2=C(C3=CC=CC=C31)NC

DOS

IR

Vibrations