Geometry & MOs

Info

ID:	259059
PubChem CID:	103158114
Reduced:	ClNOC16H24 (1)
Stoich.:	ABCD16E24 (1)
Weight, g/mol:	217.167794
ΔH_f, kcal/mol:	-64.08
Dipole, Da:	2.99
IP(EA), eV:	-9.19(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methylpentyl 4-amino-3-methoxybutanoate

Drug info:

PubChemData

Smile

C[C@@H](C1=CC=CC=C1Cl)NCC(CC2CCCC2)O

DOS

IR

Vibrations