Geometry & MOs

Info

ID:	172974
PubChem CID:	75576988
Reduced:	O9C24H32 (1)
Stoich.:	A9B24C32 (1)
Weight, g/mol:	333.178752
ΔH_f, kcal/mol:	-295.87
Dipole, Da:	3.57
IP(EA), eV:	-9.72(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[2-(hydroxymethyl)-4,5-bis(methoxymethoxy)cyclopent-2-en-1-yl]carbamate

Drug info:

PubChemData

Smile

CC(=O)OCC1(C(CCC23C1C(C(C45C2C(CC(C4)C(=C)C5=O)O)(OC3)O)O)OC(=O)C)C

DOS

IR

Vibrations