Geometry & MOs

Info

ID:	271512
PubChem CID:	103681827
Reduced:	NSF2O2C14H19 (1)
Stoich.:	ABC2D2E14F19 (1)
Weight, g/mol:	357.03981
ΔH_f, kcal/mol:	-182.8
Dipole, Da:	5.54
IP(EA), eV:	-8.43(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-bromophenyl)-N-(2-hydroxy-2-methyl-3-methylsulfanylpropyl)cyclopropane-1-carboxamide

Drug info:

PubChemData

Smile

CC(CNC(=O)CCC1=CC(=C(C=C1)F)F)(CSC)O

DOS

IR

Vibrations