Geometry & MOs

Info

ID:	261880
PubChem CID:	103256609
Reduced:	O2N4C13H22 (1)
Stoich.:	A2B4C13D22 (1)
Weight, g/mol:	265.167794
ΔH_f, kcal/mol:	-58.41
Dipole, Da:	8.65
IP(EA), eV:	-9.67(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 5-[1-[(2,2-dimethylcyclopentyl)amino]ethyl]furan-2-carboxylate

Drug info:

PubChemData

Smile

CC1(CCCCC1NCCN2C=C(N=N2)C(=O)O)C

DOS

IR

Vibrations