Geometry & MOs

Info

ID:	412813
PubChem CID:	135085742
Reduced:	O4C13H22 (1)
Stoich.:	A4B13C22 (1)
Weight, g/mol:	205.110279
ΔH_f, kcal/mol:	-214.57
Dipole, Da:	1.58
IP(EA), eV:	-10.66(0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl (NE)-N-butylidenecarbamate

Drug info:

PubChemData

Smile

COC(=O)CC(CC(=O)OC)C1CCCCC1

DOS

IR

Vibrations