Geometry & MOs

Info

ID:	216385
PubChem CID:	85086136
Reduced:	N3O3C13H15 (1)
Stoich.:	A3B3C13D15 (1)
Weight, g/mol:	261.157623
ΔH_f, kcal/mol:	-75.32
Dipole, Da:	2.3
IP(EA), eV:	-8.81(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[5-(3-amino-6-methoxyoxan-2-yl)-2,2-dimethyl-1,3-dioxolan-4-yl]methanol

Drug info:

PubChemData

Smile

CCOC(=O)C(=NNC)C1C2=CC=CC=C2NC1=O

DOS

IR

Vibrations