Geometry & MOs

Info

ID:	190463
PubChem CID:	78008880
Reduced:	S2N3O6C28H35 (1)
Stoich.:	A2B3C6D28E35 (1)
Weight, g/mol:	567.149778
ΔH_f, kcal/mol:	-213.22
Dipole, Da:	4.77
IP(EA), eV:	-9.06(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-[2-[(2-benzyl-3-methoxy-3-oxopropanoyl)amino]-2-(5-phenyl-4,5-dihydro-1,3-thiazol-2-yl)ethyl]phenyl]sulfamic acid

Drug info:

PubChemData

Smile

COC(=O)C(CC1=CC=CC=C1)C(=O)NC(CC2=CC=C(C=C2)NS(=O)(=O)O)C3=NC(CS3)C4CCCCC4

DOS

IR

Vibrations