Geometry & MOs

Info

ID:	204654
PubChem CID:	79993941
Reduced:	ClN4C12H21 (1)
Stoich.:	AB4C12D21 (1)
Weight, g/mol:	266.163043
ΔH_f, kcal/mol:	11.14
Dipole, Da:	2.89
IP(EA), eV:	-8.98(0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 5-[(3-amino-5-methylpiperidin-1-yl)methyl]-2-methylfuran-3-carboxylate

Drug info:

PubChemData

Smile

CC1CC(CN(C1)CC2=C(C(=NN2C)C)Cl)N

DOS

IR

Vibrations