Geometry & MOs

Info

ID:	65438
PubChem CID:	29214976
Reduced:	SO3N5C15H25 (1)
Stoich.:	AB3C5D15E25 (1)
Weight, g/mol:	507.168873
ΔH_f, kcal/mol:	-121.0
Dipole, Da:	4.76
IP(EA), eV:	-8.65(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[4-amino-5-[(2Z)-2-(naphthalen-1-ylmethylidene)hydrazinyl]-1,2,4-triazol-3-yl]sulfanyl]-N-(3,4,5-trimethoxyphenyl)acetamide

Drug info:

PubChemData

Smile

CCCCNC(=S)N(C)NC(=O)CN1C(=O)C2(CCCC2)NC1=O

DOS

IR

Vibrations