Geometry & MOs

Info

ID:	307446
PubChem CID:	125299963
Reduced:	SO2N5C15H15 (1)
Stoich.:	AB2C5D15E15 (1)
Weight, g/mol:	410.150954
ΔH_f, kcal/mol:	34.11
Dipole, Da:	8.38
IP(EA), eV:	-8.38(-1.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-N-[2-(5-chloro-2H-indol-3-yl)ethyl]-1-ethyl-7-methyl-4-oxo-2,3-dihydro-1,8-naphthyridine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=NC(=O)C2=C(N=NN2C1)C(=O)NCC3=CC=C(C=C3)SC

DOS

IR

Vibrations