Geometry & MOs

Info

ID:	62159
PubChem CID:	26717805
Reduced:	SO4N5C24H25 (1)
Stoich.:	AB4C5D24E25 (1)
Weight, g/mol:	479.162725
ΔH_f, kcal/mol:	-86.95
Dipole, Da:	9.56
IP(EA), eV:	-8.77(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCN(CC)C1=NC(=O)[C@H](S1)CC(=O)NC2=CC=CC(=C2)C(=O)NC3=CC4=C(C=C3)OC(=N4)C

DOS

IR

Vibrations