Geometry & MOs

Info

ID:	123753
PubChem CID:	50860910
Reduced:	N2O2C25H32 (1)
Stoich.:	A2B2C25D32 (1)
Weight, g/mol:	397.19209
ΔH_f, kcal/mol:	-65.07
Dipole, Da:	4.73
IP(EA), eV:	-7.77(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(Z)-(7-chloro-1-ethyl-2,2,4-trimethyl-3,4-dihydroquinolin-6-yl)methylideneamino]-4-methylbenzamide

Drug info:

PubChemData

Smile

CCN1C2=C(C=C(C(=C2)C)C=NC3=C(C=CC(=C3)C(=O)OC)C)C(CC1(C)C)C

DOS

IR

Vibrations