Geometry & MOs

Info

ID:	27044
PubChem CID:	813355
Reduced:	SO2N3C16H23 (1)
Stoich.:	AB2C3D16E23 (1)
Weight, g/mol:	315.158292
ΔH_f, kcal/mol:	-59.45
Dipole, Da:	7.18
IP(EA), eV:	-9.4(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2R)-butan-2-yl]-4-methyl-N-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]benzamide

Drug info:

PubChemData

Smile

CC1=CN=C(S1)NC(=O)CN(C2CC2)C(=O)C3CCCCC3

DOS

IR

Vibrations