Geometry & MOs

Info

ID:	257141
PubChem CID:	103144036
Reduced:	N4C15H20 (1)
Stoich.:	A4B15C20 (1)
Weight, g/mol:	286.178024
ΔH_f, kcal/mol:	47.26
Dipole, Da:	4.08
IP(EA), eV:	-9.26(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-ethoxycarbonyl-4-methyl-2-[(5-methyloxolan-2-yl)methyl]pentanoic acid

Drug info:

PubChemData

Smile

CCC1=NN(C(=N1)CC)C2=CC=CC3=C2CNCC3

DOS

IR

Vibrations