Geometry & MOs

Info

ID:	345752
PubChem CID:	127270052
Reduced:	N3O3C20H29 (1)
Stoich.:	A3B3C20D29 (1)
Weight, g/mol:	258.173213
ΔH_f, kcal/mol:	-139.29
Dipole, Da:	4.61
IP(EA), eV:	-8.29(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

cycloheptyl(3,4-dihydro-2H-1,5-naphthyridin-1-yl)methanone

Drug info:

PubChemData

Smile

C1CCCC(CC1)C(=O)NC2=CC=C(C=C2)NC(=O)NCC3CCCO3

DOS

IR

Vibrations