Geometry & MOs

Info

ID:	420451
PubChem CID:	135113213
Reduced:	N4C21H28 (1)
Stoich.:	A4B21C28 (1)
Weight, g/mol:	373.200156
ΔH_f, kcal/mol:	37.18
Dipole, Da:	3.21
IP(EA), eV:	-8.75(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(3S,4R)-3-hydroxy-4-[(3-methyl-1,2-oxazol-5-yl)methyl]pyrrolidin-1-yl]-N-[(4-methoxyphenyl)methyl]propanamide

Drug info:

PubChemData

Smile

CC(C)C1=CC(=NC=N1)N2CCN(CC2)C3CCC4=CC=CC=C4C3

DOS

IR

Vibrations