Geometry & MOs

Info

ID:	125594
PubChem CID:	50929401
Reduced:	SO3N4C23H24 (1)
Stoich.:	AB3C4D23E24 (1)
Weight, g/mol:	301.012574
ΔH_f, kcal/mol:	-52.43
Dipole, Da:	5.23
IP(EA), eV:	-8.69(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-2-methyl-N-(1,3-thiazol-2-yl)propanamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C(C)NC(=O)CSC2=NC3=C(C(=O)N2CC4=CC=CO4)NC(=C3)C

DOS

IR

Vibrations