Geometry & MOs

Info

ID:	288778
PubChem CID:	104325720
Reduced:	FNOC17H28 (1)
Stoich.:	ABCD17E28 (1)
Weight, g/mol:	294.210742
ΔH_f, kcal/mol:	-113.83
Dipole, Da:	3.19
IP(EA), eV:	-7.89(0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-ethoxy-3-fluorophenyl)-1-propylazepan-4-amine

Drug info:

PubChemData

Smile

CCOC1=C(C=C(C=C1)NC(CC(C)C)CC(C)C)F

DOS

IR

Vibrations