Geometry & MOs

Info

ID:	73555
PubChem CID:	48418117
Reduced:	O2N3C24H29 (1)
Stoich.:	A2B3C24D29 (1)
Weight, g/mol:	391.166269
ΔH_f, kcal/mol:	-31.41
Dipole, Da:	6.57
IP(EA), eV:	-8.48(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(5-chloro-3-methyl-1,2-oxazol-4-yl)-N-[2-(4-methoxyphenyl)-2-pyrrolidin-1-ylethyl]propanamide

Drug info:

PubChemData

Smile

CN1C=C(C2=CC=CC=C21)CC(=O)NCC(C3=CC=C(C=C3)OC)N4CCCC4

DOS

IR

Vibrations