Geometry & MOs

Info

ID:	197927
PubChem CID:	79017575
Reduced:	ClSN2C14H17 (1)
Stoich.:	ABC2D14E17 (1)
Weight, g/mol:	213.132906
ΔH_f, kcal/mol:	26.48
Dipole, Da:	2.73
IP(EA), eV:	-9.07(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3,4-difluorophenyl)-N-propylpropan-2-amine

Drug info:

PubChemData

Smile

CC1=C(SC(=N1)CNCCC2=CC=C(C=C2)Cl)C

DOS

IR

Vibrations