Geometry & MOs

Info

ID:

154384

PubChem CID:

56313807

Reduced:

O2N5H25C27 (1)

Stoich.:

A2B5C25D27 (1)

Weight, g/mol:

388.182064

ΔHf, kcal/mol:

68.55

Dipole, Da:

5.23

IP(EA), eV:

-9.48(-1.25)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

4-(butan-2-ylsulfamoyl)-N-(3-phenylbutyl)benzamide

Drug info:

PubChemData

Smile

CC(CCNC(=O)C1=CC(=NC2=C1C=NN2CC3=CC=CO3)C4=CN=CC=C4)C5=CC=CC=C5

DOS

IR

Vibrations