Geometry & MOs

Info

ID:	422570
PubChem CID:	135118054
Reduced:	N3O3C20H25 (1)
Stoich.:	A3B3C20D25 (1)
Weight, g/mol:	366.157957
ΔH_f, kcal/mol:	-74.69
Dipole, Da:	3.59
IP(EA), eV:	-8.41(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[3-(3-hydroxy-3-phenylpyrrolidin-1-yl)-3-oxopropyl]-5-methyl-1,3-benzoxazol-2-one

Drug info:

PubChemData

Smile

CC(C1=C(C=CC(=C1)OC)OC)NC2=C(C=CC=N2)C(=O)N3CCCC3

DOS

IR

Vibrations