Geometry & MOs

Info

ID:	170304
PubChem CID:	75215279
Reduced:	O6C21H26 (1)
Stoich.:	A6B21C26 (1)
Weight, g/mol:	560.05898
ΔH_f, kcal/mol:	-217.82
Dipole, Da:	3.76
IP(EA), eV:	-8.01(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(5-bromopyrazolo[1,5-a]pyridin-3-yl)ethylideneamino]-2-[2-imidazol-1-ylethyl(methyl)amino]-5-nitrobenzenesulfonamide

Drug info:

PubChemData

Smile

CC1CC2=CC(=C(C(=C2C3=C(C(=C(C=C3CC1C)OC)OC)O)O)O)OC

DOS

IR

Vibrations