Geometry & MOs

Info

ID:	282376
PubChem CID:	103923827
Reduced:	NO4C11H17 (1)
Stoich.:	AB4C11D17 (1)
Weight, g/mol:	227.115758
ΔH_f, kcal/mol:	-149.48
Dipole, Da:	4.26
IP(EA), eV:	-9.28(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 5-[[[(2S)-2-hydroxypropyl]amino]methyl]-2-methylfuran-3-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C1=CC=C(O1)CNC[C@H](C)O

DOS

IR

Vibrations