Geometry & MOs

Info

ID:	345337
PubChem CID:	127269613
Reduced:	N3O3C20H31 (1)
Stoich.:	A3B3C20D31 (1)
Weight, g/mol:	276.147393
ΔH_f, kcal/mol:	-130.26
Dipole, Da:	2.14
IP(EA), eV:	-8.11(0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3,4-dihydro-2H-chromen-6-yl)-3-hydroxypiperidine-1-carboxamide

Drug info:

PubChemData

Smile

CC(C)CC(CNC(=O)NC1=CC2=C(C=C1)OCCC2)N3CCOCC3

DOS

IR

Vibrations