Geometry & MOs

Info

ID:	144266
PubChem CID:	53340173
Reduced:	NO4C17H26 (2)
Stoich.:	AB4C17D26 (2)
Weight, g/mol:	455.28964
ΔH_f, kcal/mol:	-206.59
Dipole, Da:	6.13
IP(EA), eV:	-9.22(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2,6-di(propan-2-yl)anilino]-N-[7-(hydroxyamino)-7-oxoheptyl]-N-methylpyrimidine-5-carboxamide

Drug info:

PubChemData

Smile

CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)N[C@@H](CCCCNC(=O)/C=C/C(=O)OC)C(=O)OC(CO)CO

DOS

IR

Vibrations