Geometry & MOs

Info

ID:	205215
PubChem CID:	80069815
Reduced:	NOC10H21 (1)
Stoich.:	ABC10D21 (1)
Weight, g/mol:	197.087435
ΔH_f, kcal/mol:	-83.8
Dipole, Da:	3.4
IP(EA), eV:	-9.16(2.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-aminophenyl)sulfanylbutan-2-ol

Drug info:

PubChemData

Smile

CC(C(C)O)NCC1CCCC1

DOS

IR

Vibrations