Geometry & MOs

Info

ID:	429982
PubChem CID:	135170039
Reduced:	NC17H19 (1)
Stoich.:	AB17C19 (1)
Weight, g/mol:	376.12792
ΔH_f, kcal/mol:	53.54
Dipole, Da:	2.04
IP(EA), eV:	-8.12(0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(4-butan-2-ylidenecyclohexa-2,5-dien-1-ylidene)amino]-N,N-dimethyl-3-methylsulfonylsulfanylaniline

Drug info:

PubChemData

Smile

CC/C=C/C1=CC=CC=C1N(C)C2=CC=CC=C2

DOS

IR

Vibrations