Geometry & MOs

Info

ID:

290175

PubChem CID:

104417511

Reduced:

NOC6H9 (2)

Stoich.:

ABC6D9 (2)

Weight, g/mol:

300.12407

ΔHf, kcal/mol:

-79.39

Dipole, Da:

5.28

IP(EA), eV:

-9.04(0.1)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

3-[(2-chloro-3,4-dimethoxyphenyl)methylamino]-N-ethylpropanamide

Drug info:

PubChemData

Smile

CCNC(=O)CCNCC1=CC=CC=C1O

DOS

IR

Vibrations