Geometry & MOs

Info

ID:	201637
PubChem CID:	79564433
Reduced:	ON3C14H29 (1)
Stoich.:	AB3C14D29 (1)
Weight, g/mol:	258.209599
ΔH_f, kcal/mol:	-83.18
Dipole, Da:	2.82
IP(EA), eV:	-8.58(1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(1,3,4,5-tetrahydro-2-benzazepin-2-yl)ethyl]cyclopentan-1-amine

Drug info:

PubChemData

Smile

CCCCCN(C)CCC1CCCC1(C(=O)N)N

DOS

IR

Vibrations