Geometry & MOs

Info

ID:	127437
PubChem CID:	51002258
Reduced:	NO3C24H33 (1)
Stoich.:	AB3C24D33 (1)
Weight, g/mol:	554.256292
ΔH_f, kcal/mol:	-130.37
Dipole, Da:	6.95
IP(EA), eV:	-8.64(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[6-[[[4-(3-hydroxy-2,2,4,4-tetramethylpentan-3-yl)phenyl]methyl-pyridin-3-ylsulfonylamino]methyl]pyridin-2-yl]amino]acetic acid

Drug info:

PubChemData

Smile

CC(C)(C)C1CCC(CC1)OC2=CC3=C(C=C2)C=C(C=C3)CN(C)CC(=O)O

DOS

IR

Vibrations