Geometry & MOs

Info

ID:	207792
PubChem CID:	80449910
Reduced:	ClNOSC14H22 (1)
Stoich.:	ABCDE14F22 (1)
Weight, g/mol:	293.040791
ΔH_f, kcal/mol:	-35.82
Dipole, Da:	2.3
IP(EA), eV:	-8.54(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,5-dichlorophenyl)sulfinyl-N,3-dimethylbutan-2-amine

Drug info:

PubChemData

Smile

CCC(C)C(CS(=O)C1=CC(=CC=C1)Cl)NCC

DOS

IR

Vibrations