Geometry & MOs

Info

ID:	263775
PubChem CID:	103397142
Reduced:	FNO2C17H22 (1)
Stoich.:	ABC2D17E22 (1)
Weight, g/mol:	223.100857
ΔH_f, kcal/mol:	-125.37
Dipole, Da:	2.67
IP(EA), eV:	-9.12(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(aminomethyl)cyclopropyl]-(2-fluoro-4-methoxyphenyl)methanone

Drug info:

PubChemData

Smile

COC1=CC(=C(C=C1)C(=O)C2CCC3CCCCC3N2)F

DOS

IR

Vibrations