Geometry & MOs

Info

ID:	82729
PubChem CID:	49856404
Reduced:	ClN6O6C34H43 (1)
Stoich.:	AB6C6D34E43 (1)
Weight, g/mol:	347.103669
ΔH_f, kcal/mol:	-193.11
Dipole, Da:	14.93
IP(EA), eV:	-8.57(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-amino-2-methyl-4-oxobutan-2-yl)-5-(3-chlorophenyl)-3-hydroxypyridine-2-carboxamide

Drug info:

PubChemData

Smile

CCN(CCNC1=C2C=CC(=CC2=NC=C1)Cl)CC(=O)NCCOCCOCCNC(=O)CC3=CC(=O)OC4=C3C=CC(=C4)N(C)C

DOS

IR

Vibrations