Geometry & MOs

Info

ID:	256345
PubChem CID:	103138653
Reduced:	N4C17H24 (1)
Stoich.:	A4B17C24 (1)
Weight, g/mol:	283.114319
ΔH_f, kcal/mol:	40.38
Dipole, Da:	3.07
IP(EA), eV:	-8.19(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-N-methyl-8-N-(2-thiophen-2-ylethyl)isoquinoline-5,8-diamine

Drug info:

PubChemData

Smile

CCN1CCCC1CN(C)C2=C3C=NC=CC3=C(C=C2)N

DOS

IR

Vibrations