Geometry & MOs

Info

ID:	400675
PubChem CID:	135048694
Reduced:	LiNSH20C24 (1)
Stoich.:	ABCD20E24 (1)
Weight, g/mol:	355.139471
ΔH_f, kcal/mol:	139.43
Dipole, Da:	12.4
IP(EA), eV:	-7.63(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-N-(4-methylphenyl)-N-(4-thiophen-2-ylphenyl)aniline

Drug info:

PubChemData

Smile

[Li+].CC1=CC=C(C=C1)N(C2=CC=C(C=C2)C3=CC=[C-]S3)C4=CC=CC(=C4)C

DOS

IR

Vibrations