Geometry & MOs

Info

ID:	433680
PubChem CID:	135173820
Reduced:	ClO5N7C39H42 (1)
Stoich.:	AB5C7D39E42 (1)
Weight, g/mol:	367.204848
ΔH_f, kcal/mol:	-112.64
Dipole, Da:	7.85
IP(EA), eV:	-8.06(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(2,3-dimethylphenyl)-2-methylphenyl]-3-ethyl-1,7-naphthyridin-8-amine

Drug info:

PubChemData

Smile

CC1=C(C=CC=C1NC2=NC=CC3=CC(=CN=C32)CN4CC[C@H](C4)O)C5=C(C(=CC=C5)NC(=O)C6=CC(=CN(C6O)C)CN7CC[C@H](C7)C(=O)O)Cl

DOS

IR

Vibrations