Geometry & MOs

Info

ID:	416834
PubChem CID:	135090527
Reduced:	N3O4C20H27 (1)
Stoich.:	A3B4C20D27 (1)
Weight, g/mol:	362.163043
ΔH_f, kcal/mol:	-164.05
Dipole, Da:	2.25
IP(EA), eV:	-9.01(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-hydroxy-2-methyl-N-[(3R,4S)-4-(quinolin-4-ylmethyl)oxolan-3-yl]benzamide

Drug info:

PubChemData

Smile

C[C@@]1(CC2(CCN(CC2)C(=O)CCC3=NC4=CC=CC=C4N3)OC[C@@H]1O)O

DOS

IR

Vibrations