Geometry & MOs

Info

ID:	369447
PubChem CID:	127333409
Reduced:	N3O3C19H29 (1)
Stoich.:	A3B3C19D29 (1)
Weight, g/mol:	262.131742
ΔH_f, kcal/mol:	-122.58
Dipole, Da:	5.28
IP(EA), eV:	-7.78(0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CN(C)CCN(CC1CCCO1)C(=O)NC2=CC3=C(C=C2)OCCC3

DOS

IR

Vibrations