Geometry & MOs

Info

ID:	27045
PubChem CID:	813618
Reduced:	N3O3C17H21 (1)
Stoich.:	A3B3C17D21 (1)
Weight, g/mol:	315.158292
ΔH_f, kcal/mol:	-62.17
Dipole, Da:	6.44
IP(EA), eV:	-9.52(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2S)-butan-2-yl]-2-methyl-N-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]benzamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations