Geometry & MOs

Info

ID:	49133
PubChem CID:	11528746
Reduced:	NSF2O3C7H15 (1)
Stoich.:	ABC2D3E7F15 (1)
Weight, g/mol:	231.125929
ΔH_f, kcal/mol:	-261.08
Dipole, Da:	3.54
IP(EA), eV:	-9.86(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-hydroxypyrrolidin-1-yl)-(1-phenylcyclopropyl)methanone

Drug info:

PubChemData

Smile

CC(C)CC(C(CS(=O)(=O)O)(F)F)N

DOS

IR

Vibrations