Geometry & MOs

Info

ID:	255968
PubChem CID:	103135984
Reduced:	NO3C13H25 (1)
Stoich.:	AB3C13D25 (1)
Weight, g/mol:	242.178299
ΔH_f, kcal/mol:	-169.84
Dipole, Da:	7.04
IP(EA), eV:	-9.04(0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-isoquinolin-8-yl-N,3,3-trimethylbutan-1-amine

Drug info:

PubChemData

Smile

CC1CCC(O1)CNCCC(C)CCC(=O)O

DOS

IR

Vibrations