Geometry & MOs

Info

ID:	330745
PubChem CID:	127248152
Reduced:	N3O3C24H25 (1)
Stoich.:	A3B3C24D25 (1)
Weight, g/mol:	447.215806
ΔH_f, kcal/mol:	-30.07
Dipole, Da:	1.34
IP(EA), eV:	-9.41(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(3-methoxyphenyl)acetyl]-N-methyl-3-[[3-(2-methylphenyl)-1,2-oxazol-5-yl]methyl]pyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=CC=CC=C1C2=NOC(=C2)CC3(CCN(C3)C(=O)C4=CC=CC=C4)C(=O)NC

DOS

IR

Vibrations