Geometry & MOs

Info

ID:

369167

PubChem CID:

127331468

Reduced:

NO4C20H29 (1)

Stoich.:

AB4C20D29 (1)

Weight, g/mol:

293.210327

ΔHf, kcal/mol:

-183.41

Dipole, Da:

6.53

IP(EA), eV:

-9.4(-0.53)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

N-[(2-tert-butyloxan-3-yl)methyl]-3-imidazol-1-ylpropanamide

Drug info:

PubChemData

Smile

CC1=C(OC2=C1C(=O)CCC2)C(=O)NCC3CCCOC3C(C)(C)C

DOS

IR

Vibrations