Geometry & MOs

Info

ID:	12676
PubChem CID:	143623
Reduced:	ClNOC11H18 (1)
Stoich.:	ABCD11E18 (1)
Weight, g/mol:	215.107692
ΔH_f, kcal/mol:	-66.73
Dipole, Da:	0.37
IP(EA), eV:	-8.75(0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-butoxyphenyl)methanamine;hydrochloride

Drug info:

PubChemData

Smile

CCCCOC1=CC=C(C=C1)CN.Cl

DOS

IR

Vibrations