Geometry & MOs

Info

ID:	153638
PubChem CID:	56312914
Reduced:	N3O3C21H29 (1)
Stoich.:	A3B3C21D29 (1)
Weight, g/mol:	375.161663
ΔH_f, kcal/mol:	-139.77
Dipole, Da:	1.58
IP(EA), eV:	-9.44(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-methyl-1,2-oxazol-3-yl)-2-[2-oxo-2-(3-phenylbutylamino)ethyl]sulfanylpropanamide

Drug info:

PubChemData

Smile

CC1CCCCC12C(=O)N(C(=O)N2)CC(=O)NCCC(C)C3=CC=CC=C3

DOS

IR

Vibrations