Geometry & MOs

Info

ID:	59404
PubChem CID:	24855039
Reduced:	O2N4H22C23 (1)
Stoich.:	A2B4C22D23 (1)
Weight, g/mol:	515.115325
ΔH_f, kcal/mol:	15.32
Dipole, Da:	7.21
IP(EA), eV:	-8.26(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[4-[[(1R)-1-(4,5-dimethylthiophen-2-yl)-2-methylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-N,N-diethyl-3-hydroxythiophene-2-sulfonamide

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)C)NC2=C(N=C3N2C=CC=C3)C4=CC=CC=C4OCC(=O)N

DOS

IR

Vibrations