Geometry & MOs

Info

ID:	202204
PubChem CID:	79642332
Reduced:	NOC8H15 (2)
Stoich.:	ABC8D15 (2)
Weight, g/mol:	256.178693
ΔH_f, kcal/mol:	-130.87
Dipole, Da:	7.43
IP(EA), eV:	-9.42(1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-amino-3-[3-(methoxymethyl)pyrrolidin-1-yl]cyclohexane-1-carboxylic acid

Drug info:

PubChemData

Smile

CC(C)C1CCCN(CC1)C2CCCC(C2)(C(=O)O)N

DOS

IR

Vibrations