Geometry & MOs

Info

ID:	123671
PubChem CID:	50858411
Reduced:	OCl2N3C22H25 (1)
Stoich.:	AB2C3D22E25 (1)
Weight, g/mol:	351.194677
ΔH_f, kcal/mol:	-11.19
Dipole, Da:	7.33
IP(EA), eV:	-8.13(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-nitrophenyl)-1-(1,2,2,4,7-pentamethyl-3,4-dihydroquinolin-6-yl)methanimine

Drug info:

PubChemData

Smile

CC1CC(N(C2=C1C=C(C(=C2)C)/C=N\NC(=O)C3=CC(=C(C=C3)Cl)Cl)C)(C)C

DOS

IR

Vibrations