Geometry & MOs

Info

ID:

190357

PubChem CID:

77990676

Reduced:

NO7H17C21 (1)

Stoich.:

AB7C17D21 (1)

Weight, g/mol:

223.100857

ΔHf, kcal/mol:

-221.12

Dipole, Da:

3.15

IP(EA), eV:

-9.32(-1.92)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

2-but-2-en-2-yl-4-fluoro-N-methoxybenzamide

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C3=C(C4=CC=CC=C4C3=O)N(C2=O)C(=O)C(C(C(CO)O)O)O

DOS

IR

Vibrations