Geometry & MOs

Info

ID:	337845
PubChem CID:	127258468
Reduced:	O4C15H28 (1)
Stoich.:	A4B15C28 (1)
Weight, g/mol:	173.141579
ΔH_f, kcal/mol:	-238.44
Dipole, Da:	3.5
IP(EA), eV:	-10.61(0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(aminomethyl)butyl butanoate

Drug info:

PubChemData

Smile

CCCCC(C)C(C(C)OC(=O)CCC)OC(=O)C

DOS

IR

Vibrations