Geometry & MOs

Info

ID:	273086
PubChem CID:	103770468
Reduced:	ClNSF2O2H10C12 (1)
Stoich.:	ABCD2E2F10G12 (1)
Weight, g/mol:	271.138385
ΔH_f, kcal/mol:	-158.52
Dipole, Da:	6.4
IP(EA), eV:	-9.13(-1.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-butyl-N-(3,3-difluoro-2-hydroxypropyl)benzamide

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=C(S2)C(=O)NCC(C(F)F)O)Cl

DOS

IR

Vibrations