Geometry & MOs

Info

ID:	202284
PubChem CID:	79651613
Reduced:	O2N3C15H27 (1)
Stoich.:	A2B3C15D27 (1)
Weight, g/mol:	267.194677
ΔH_f, kcal/mol:	-81.5
Dipole, Da:	5.12
IP(EA), eV:	-8.48(0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-amino-3-[4-(cyclopropylmethyl)piperazin-1-yl]cyclopentane-1-carboxylic acid

Drug info:

PubChemData

Smile

CCNC1(CCC(C1)N2CCN(CC2)C3CC3)C(=O)O

DOS

IR

Vibrations