Geometry & MOs

Info

ID:	209600
PubChem CID:	80693480
Reduced:	NC17H25 (1)
Stoich.:	AB17C25 (1)
Weight, g/mol:	311.08848
ΔH_f, kcal/mol:	-17.3
Dipole, Da:	1.11
IP(EA), eV:	-8.75(0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(3-bromo-4-methoxyphenyl)methyl]-3,3-dimethylcyclopentan-1-amine

Drug info:

PubChemData

Smile

CC1(CCC(C1)NC2CCCC3=CC=CC=C23)C

DOS

IR

Vibrations