Geometry & MOs

Info

ID:	273590
PubChem CID:	103771429
Reduced:	N2O5C14H20 (1)
Stoich.:	A2B5C14D20 (1)
Weight, g/mol:	300.150764
ΔH_f, kcal/mol:	-135.23
Dipole, Da:	3.54
IP(EA), eV:	-10.24(-1.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-N-(2-hydroxy-4-methylpentyl)acetamide

Drug info:

PubChemData

Smile

CC(C)CC(CNC(=O)COC1=CC=C(C=C1)[N+](=O)[O-])O

DOS

IR

Vibrations