Geometry & MOs

Info

ID:	441768
PubChem CID:	135243999
Reduced:	NH27C43 (1)
Stoich.:	AB27C43 (1)
Weight, g/mol:	370.240899
ΔH_f, kcal/mol:	186.47
Dipole, Da:	3.17
IP(EA), eV:	-8.02(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[C-[4-butan-2-yl-3-(2-methylphenyl)phenyl]-N-methylcarbonimidoyl]-N-methylaniline

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C=CC3=C2C4=C(N3C5=CC=C(C=C5)C6C7=CC=CC=C7C8=CC=CC=C68)C9=CC=CC=C9C1=CC=CC=C14

DOS

IR

Vibrations