Geometry & MOs

Info

ID:

256931

PubChem CID:

103142492

Reduced:

N3O3C14H15 (1)

Stoich.:

A3B3C14D15 (1)

Weight, g/mol:

259.204848

ΔHf, kcal/mol:

19.67

Dipole, Da:

7.63

IP(EA), eV:

-9.28(-1.63)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

N-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]-1,2,3,4-tetrahydroisoquinolin-8-amine

Drug info:

PubChemData

Smile

C1CC1N(CCO)C2=C3C=NC=CC3=C(C=C2)[N+](=O)[O-]

DOS

IR

Vibrations