Geometry & MOs

Info

ID:	273039
PubChem CID:	103770371
Reduced:	NSF2O2C12H15 (1)
Stoich.:	ABC2D2E12F15 (1)
Weight, g/mol:	370.97354
ΔH_f, kcal/mol:	-179.02
Dipole, Da:	5.47
IP(EA), eV:	-8.76(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-bromo-4-chlorophenoxy)-N-(3,3-difluoro-2-hydroxypropyl)propanamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)SC)C(=O)NCC(C(F)F)O

DOS

IR

Vibrations