Geometry & MOs

Info

ID:	256533
PubChem CID:	103139750
Reduced:	ClNOC11H22 (1)
Stoich.:	ABCD11E22 (1)
Weight, g/mol:	264.126263
ΔH_f, kcal/mol:	-86.08
Dipole, Da:	3.17
IP(EA), eV:	-8.86(0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-(3-ethylphenoxy)isoquinolin-5-amine

Drug info:

PubChemData

Smile

CC1CCC(O1)CN(CCCl)C(C)C

DOS

IR

Vibrations