Geometry & MOs

Info

ID:	418830
PubChem CID:	135106935
Reduced:	N3O4C19H21 (1)
Stoich.:	A3B4C19D21 (1)
Weight, g/mol:	353.173942
ΔH_f, kcal/mol:	-101.99
Dipole, Da:	12.82
IP(EA), eV:	-8.88(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-oxo-2-pyrrolidin-1-yl-N-[(3S,4S)-4-(quinolin-4-ylmethyl)oxolan-3-yl]acetamide

Drug info:

PubChemData

Smile

COC1=CC=CC2=C1C3(CCN(CC3)C4=NN=C(C=C4)C(=O)O)OCC2

DOS

IR

Vibrations