Geometry & MOs

Info

ID:	288945
PubChem CID:	104328803
Reduced:	FON2C17H25 (1)
Stoich.:	ABC2D17E25 (1)
Weight, g/mol:	224.132491
ΔH_f, kcal/mol:	-99.4
Dipole, Da:	3.11
IP(EA), eV:	-8.96(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-aminobutyl)-4-fluoro-2-methylbenzamide

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)F)C(=O)N2CCCC(C2)CNC(C)C

DOS

IR

Vibrations