Geometry & MOs

Info

ID:	38519
PubChem CID:	8136972
Reduced:	N2O5C21H22 (1)
Stoich.:	A2B5C21D22 (1)
Weight, g/mol:	265.142641
ΔH_f, kcal/mol:	-139.16
Dipole, Da:	6.96
IP(EA), eV:	-9.55(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(cyclopropylamino)-2-oxoethyl]-3-(3,5-dimethyl-1,2-oxazol-4-yl)propanamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)C(=O)NCC(=O)O[C@H](C2=CC=CC=C2)C(=O)NC3CC3

DOS

IR

Vibrations