Geometry & MOs

Info

ID:

196680

PubChem CID:

78863501

Reduced:

N3O3C27H29 (1)

Stoich.:

A3B3C27D29 (1)

Weight, g/mol:

304.142307

ΔHf, kcal/mol:

-77.97

Dipole, Da:

6.27

IP(EA), eV:

-8.68(-0.76)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

2-(2,5-dimethoxyphenyl)-N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]acetamide

Drug info:

PubChemData

Smile

CCN(CC)C(=O)CC1=CC=C(C=C1)NC(=O)CNC(=O)C2=CC=C(C=C2)C3=CC=CC=C3

DOS

IR

Vibrations