Geometry & MOs

Info

ID:	258680
PubChem CID:	103156264
Reduced:	NOC7H14 (2)
Stoich.:	ABC7D14 (2)
Weight, g/mol:	259.132077
ΔH_f, kcal/mol:	-124.76
Dipole, Da:	4.51
IP(EA), eV:	-9.21(1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-N-isoquinolin-8-yl-3-methoxybutanamide

Drug info:

PubChemData

Smile

CC1(CCC(CC1)N(C)C(=O)CC(CN)OC)C

DOS

IR

Vibrations