Geometry & MOs

Info

ID:	256482
PubChem CID:	103139532
Reduced:	NOC18H23 (1)
Stoich.:	ABC18D23 (1)
Weight, g/mol:	252.137497
ΔH_f, kcal/mol:	-30.87
Dipole, Da:	2.95
IP(EA), eV:	-9.23(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-(2-propylimidazol-1-yl)isoquinolin-5-amine

Drug info:

PubChemData

Smile

C1CCC(CC1)CCC(C2=CC=CC3=C2C=NC=C3)O

DOS

IR

Vibrations