Geometry & MOs

Info

ID:	430501
PubChem CID:	135170565
Reduced:	N3C8H15 (1)
Stoich.:	A3B8C15 (1)
Weight, g/mol:	269.162708
ΔH_f, kcal/mol:	15.17
Dipole, Da:	3.53
IP(EA), eV:	-9.4(0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl (4-tert-butyl-1-methyl-5-oxo-2H-pyrrol-2-yl) carbonate

Drug info:

PubChemData

Smile

CC1=NC(=NN1C)C(C)(C)C

DOS

IR

Vibrations