Geometry & MOs

Info

ID:	198562
PubChem CID:	79119092
Reduced:	FNC16H24 (1)
Stoich.:	ABC16D24 (1)
Weight, g/mol:	209.21435
ΔH_f, kcal/mol:	-59.82
Dipole, Da:	3.6
IP(EA), eV:	-8.9(0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-methylidenebutyl)-2-propan-2-ylazepane

Drug info:

PubChemData

Smile

CCCC1(CCCCCN1)CC2=CC(=CC=C2)F

DOS

IR

Vibrations