Geometry & MOs

Info

ID:	144830
PubChem CID:	53420904
Reduced:	Cl2N2O2C13H18 (1)
Stoich.:	A2B2C2D13E18 (1)
Weight, g/mol:	252.132136
ΔH_f, kcal/mol:	-23.49
Dipole, Da:	28.05
IP(EA), eV:	-7.27(-3.4)
Spin(S_z, S²):	None, None
Charge, e:	-2

Chem-info

IUPAC name:

2-methyl-2-propylpropane-1,3-diol;dicarbamate

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)Cl)NC(=O)C[N+]CCCOC.[Cl-]

DOS

IR

Vibrations