Geometry & MOs

Info

ID:

75527

PubChem CID:

48423606

Reduced:

NOC10H15 (2)

Stoich.:

ABC10D15 (2)

Weight, g/mol:

359.257277

ΔHf, kcal/mol:

-68.23

Dipole, Da:

4.0

IP(EA), eV:

-8.51(0.21)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

2-(cyclopropylmethoxy)-N-[[2-[(4-ethylpiperazin-1-yl)methyl]phenyl]methyl]propanamide

Drug info:

PubChemData

Smile

CC1CCCN(C1)CC2=CC=C(C=C2)NC(=O)C(C)OCC3CC3

DOS

IR

Vibrations