Geometry & MOs

Info

ID:	259075
PubChem CID:	103158158
Reduced:	BrNOC15H22 (1)
Stoich.:	ABCD15E22 (1)
Weight, g/mol:	215.152144
ΔH_f, kcal/mol:	-61.09
Dipole, Da:	3.15
IP(EA), eV:	-8.33(0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

cyclopentylmethyl 4-amino-3-methoxybutanoate

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)NCC(CC2CCCC2)O)Br

DOS

IR

Vibrations