Geometry & MOs

Info

ID:	339734
PubChem CID:	127261736
Reduced:	ClO2N5C12H12 (1)
Stoich.:	AB2C5D12E12 (1)
Weight, g/mol:	298.168128
ΔH_f, kcal/mol:	-4.37
Dipole, Da:	3.94
IP(EA), eV:	-9.2(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-methyl-4,4-diphenylbutan-2-yl) N-aminocarbamate

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)COC(=O)NN)C2=C(C(=NC=N2)Cl)N

DOS

IR

Vibrations