Geometry & MOs

Info

ID:	262308
PubChem CID:	103283978
Reduced:	ClON2C14H21 (1)
Stoich.:	ABC2D14E21 (1)
Weight, g/mol:	243.219829
ΔH_f, kcal/mol:	-36.82
Dipole, Da:	4.35
IP(EA), eV:	-9.66(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methylpentyl 6-amino-4,4-dimethylhexanoate

Drug info:

PubChemData

Smile

CCCC(C)COCC1=C(C=C(C=C1)C(=N)N)Cl

DOS

IR

Vibrations