Geometry & MOs

Info

ID:	207170
PubChem CID:	80355115
Reduced:	OSN4C9H16 (1)
Stoich.:	ABC4D9E16 (1)
Weight, g/mol:	253.124883
ΔH_f, kcal/mol:	0.32
Dipole, Da:	5.32
IP(EA), eV:	-8.36(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-aminophenyl)-2-[2-(dimethylamino)ethylsulfanyl]acetamide

Drug info:

PubChemData

Smile

CN(C)CCSC1=NC=NC(=C1N)OC

DOS

IR

Vibrations