Geometry & MOs

Info

ID:

364170

PubChem CID:

127314466

Reduced:

NOC7H13 (2)

Stoich.:

ABC7D13 (2)

Weight, g/mol:

375.215806

ΔHf, kcal/mol:

-108.52

Dipole, Da:

5.05

IP(EA), eV:

-9.66(1.11)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

4-[3-(4-methoxyphenyl)propanoyl]-N-[(3-methyloxetan-3-yl)methyl]piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CC1CCC(CC1)CNC(=O)NCC2(COC2)C

DOS

IR

Vibrations