Geometry & MOs

Info

ID:	17548
PubChem CID:	504140
Reduced:	S3O4N5C16H17 (1)
Stoich.:	A3B4C5D16E17 (1)
Weight, g/mol:	439.044268
ΔH_f, kcal/mol:	-67.67
Dipole, Da:	4.6
IP(EA), eV:	-9.14(-1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[[4-(2-ethoxy-2-oxoethyl)-1,3-thiazol-2-yl]amino]-2-oxoethyl]sulfanyl-N-(pyridine-4-carbonyl)methanehydrazonothioic acid

Drug info:

PubChemData

Smile

CCOC(=O)CC1=CSC(=N1)NC(=O)CSC(=NNC(=O)C2=CC=NC=C2)S

DOS

IR

Vibrations