Geometry & MOs

Info

ID:	201364
PubChem CID:	79528089
Reduced:	BrSN2C14H17 (1)
Stoich.:	ABC2D14E17 (1)
Weight, g/mol:	216.012412
ΔH_f, kcal/mol:	25.17
Dipole, Da:	4.62
IP(EA), eV:	-8.64(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-amino-5-chlorophenyl)sulfanylacetamide

Drug info:

PubChemData

Smile

CC1(CCCC1)CNC2=NC3=C(S2)C=C(C=C3)Br

DOS

IR

Vibrations