Geometry & MOs

Info

ID:	410747
PubChem CID:	135083548
Reduced:	ClO2C13H13 (1)
Stoich.:	AB2C13D13 (1)
Weight, g/mol:	199.157229
ΔH_f, kcal/mol:	-63.0
Dipole, Da:	1.4
IP(EA), eV:	-9.72(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-(4-methylpent-1-enyl)carbamate

Drug info:

PubChemData

Smile

C1C/C(=C\C(=O)C2=CC=CC=C2)/OC1CCl

DOS

IR

Vibrations