Geometry & MOs

Info

ID:	328789
PubChem CID:	126727795
Reduced:	NC7H9 (2)
Stoich.:	AB7C9 (2)
Weight, g/mol:	298.063968
ΔH_f, kcal/mol:	43.14
Dipole, Da:	3.95
IP(EA), eV:	-9.7(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-(3,5-dichloro-1,2-dihydropyridin-2-yl)propan-2-yloxy]aniline

Drug info:

PubChemData

Smile

CC1=CC(=NC1C2=CN=CC=C2)C(C)(C)C

DOS

IR

Vibrations