Geometry & MOs

Info

ID:	284759
PubChem CID:	104069081
Reduced:	SN2O3C13H16 (1)
Stoich.:	AB2C3D13E16 (1)
Weight, g/mol:	253.11365
ΔH_f, kcal/mol:	-98.81
Dipole, Da:	2.7
IP(EA), eV:	-9.36(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-diethyl-2-[4-(hydroxymethyl)phenyl]sulfanylacetamide

Drug info:

PubChemData

Smile

C=CCNC(=O)NC(=O)CSC1=CC=C(C=C1)CO

DOS

IR

Vibrations