Geometry & MOs

Info

ID:	62158
PubChem CID:	26717804
Reduced:	SN3O5H21C22 (1)
Stoich.:	AB3C5D21E22 (1)
Weight, g/mol:	479.162725
ΔH_f, kcal/mol:	-104.01
Dipole, Da:	5.66
IP(EA), eV:	-8.96(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[2-[(5R)-2-(diethylamino)-4-oxo-1,3-thiazol-5-yl]acetyl]amino]-N-(2-methyl-1,3-benzoxazol-5-yl)benzamide

Drug info:

PubChemData

Smile

CC(=O)NC1=CC=C(C=C1)SCC(=O)NNC(=O)C2=CC=C(O2)COC3=CC=CC=C3

DOS

IR

Vibrations