Geometry & MOs

Info

ID:	27062
PubChem CID:	814118
Reduced:	N3O4C14H17 (1)
Stoich.:	A3B4C14D17 (1)
Weight, g/mol:	321.114713
ΔH_f, kcal/mol:	-73.37
Dipole, Da:	5.57
IP(EA), eV:	-9.51(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2R)-butan-2-yl]-N-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]-2-thiophen-2-ylacetamide

Drug info:

PubChemData

Smile

CC[C@H](C)N(CC(=O)NC1=NOC=C1)C(=O)C2=CC=CO2

DOS

IR

Vibrations