Geometry & MOs

Info

ID:	216853
PubChem CID:	85086883
Reduced:	N3O6C13H15 (1)
Stoich.:	A3B6C13D15 (1)
Weight, g/mol:	309.121237
ΔH_f, kcal/mol:	-174.45
Dipole, Da:	11.87
IP(EA), eV:	-9.68(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl N-[4-methoxy-5-(methoxymethyl)-2-oxooxolan-3-yl]carbamate

Drug info:

PubChemData

Smile

CC(=O)NC(CCC(=O)NC1=CC=C(C=C1)[N+](=O)[O-])C(=O)O

DOS

IR

Vibrations