Geometry & MOs

Info

ID:	58706
PubChem CID:	24714748
Reduced:	NO5C16H21 (1)
Stoich.:	AB5C16D21 (1)
Weight, g/mol:	291.147058
ΔH_f, kcal/mol:	-150.3
Dipole, Da:	4.21
IP(EA), eV:	-9.1(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 5-[[(5-methylfuran-2-yl)methyl-propan-2-ylamino]methyl]furan-2-carboxylate

Drug info:

PubChemData

Smile

CC1=CC=C(O1)CN(CCOC)CC2=CC=C(O2)C(=O)OC

DOS

IR

Vibrations