Geometry & MOs

Info

ID:	275552
PubChem CID:	103816568
Reduced:	NOC4H5 (3)
Stoich.:	ABC4D5 (3)
Weight, g/mol:	214.072926
ΔH_f, kcal/mol:	-32.9
Dipole, Da:	6.36
IP(EA), eV:	-9.75(-1.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(3S)-3-aminopyrrolidin-1-yl]-2,2,3,3-tetrafluoropropan-1-one

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1)[N+](=O)[O-])C(=O)N2CC[C@@H](C2)N

DOS

IR

Vibrations