Geometry & MOs

Info

ID:	77359
PubChem CID:	48426262
Reduced:	N3O3C17H21 (1)
Stoich.:	A3B3C17D21 (1)
Weight, g/mol:	328.101227
ΔH_f, kcal/mol:	-87.61
Dipole, Da:	1.43
IP(EA), eV:	-9.18(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[2-[(3-chlorophenyl)methylsulfanyl]acetyl]amino]-N,N-diethylacetamide

Drug info:

PubChemData

Smile

CCN(CC)C(=O)CNC(=O)C1=C(OC(=N1)C2=CC=CC=C2)C

DOS

IR

Vibrations