Geometry & MOs

Info

ID:	162167
PubChem CID:	57393819
Reduced:	ClON4H17C22 (1)
Stoich.:	ABC4D17E22 (1)
Weight, g/mol:	306.122909
ΔH_f, kcal/mol:	68.33
Dipole, Da:	3.68
IP(EA), eV:	-8.94(-1.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[7-(1H-1,2,4-triazol-5-yl)benzo[c][2,6]naphthyridin-5-yl]amino]ethanol

Drug info:

PubChemData

Smile

C1CC1NC(=O)C2=CC=CC3=C4C=NC=CC4=C(N=C32)NC5=CC(=CC=C5)Cl

DOS

IR

Vibrations