Geometry & MOs

Info

ID:	205896
PubChem CID:	80173886
Reduced:	N2O2C15H18 (1)
Stoich.:	A2B2C15D18 (1)
Weight, g/mol:	264.163791
ΔH_f, kcal/mol:	-49.42
Dipole, Da:	4.45
IP(EA), eV:	-8.51(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-amino-2-fluorophenyl)-(3,3-diethylpyrrolidin-1-yl)methanone

Drug info:

PubChemData

Smile

CC1(CCN(C1)C(=O)C2=CC3=C(O2)C=CC(=C3)N)C

DOS

IR

Vibrations