Geometry & MOs

Info

ID:	76980
PubChem CID:	48425661
Reduced:	SO2N3C19H25 (1)
Stoich.:	AB2C3D19E25 (1)
Weight, g/mol:	342.136176
ΔH_f, kcal/mol:	-67.4
Dipole, Da:	3.75
IP(EA), eV:	-8.68(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-diethyl-2-[[2-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]sulfanylacetyl]amino]acetamide

Drug info:

PubChemData

Smile

CCN(CC)C(=O)CNC(=O)CC1=C(N=C(S1)C)C2=CC=C(C=C2)C

DOS

IR

Vibrations