Geometry & MOs

Info

ID:	442033
PubChem CID:	135248212
Reduced:	N3H19C20 (1)
Stoich.:	A3B19C20 (1)
Weight, g/mol:	307.157229
ΔH_f, kcal/mol:	93.71
Dipole, Da:	5.38
IP(EA), eV:	-8.59(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methoxy-N-(6-methoxycyclohexa-1,5-dien-1-yl)-N-phenylaniline

Drug info:

PubChemData

Smile

C1CC(CCC1C#N)N(C2=CC=CC=C2)C3=CC=C(C=C3)C#N

DOS

IR

Vibrations