Geometry & MOs

Info

ID:	414636
PubChem CID:	135087595
Reduced:	N2O3C21H26 (1)
Stoich.:	A2B3C21D26 (1)
Weight, g/mol:	381.168856
ΔH_f, kcal/mol:	-121.25
Dipole, Da:	3.72
IP(EA), eV:	-8.39(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(3R,4R)-3-methoxy-4-[(3-methyl-1,2-oxazol-5-yl)methyl]pyrrolidine-1-carbonyl]-6-methyl-1H-quinolin-2-one

Drug info:

PubChemData

Smile

CC1(CCOC2(C1)CCN(CC2)C(=O)NC3=CC4=CC=CC=C4C=C3)O

DOS

IR

Vibrations