Geometry & MOs

Info

ID:	430620
PubChem CID:	135170686
Reduced:	NO4C11H17 (1)
Stoich.:	AB4C11D17 (1)
Weight, g/mol:	227.115758
ΔH_f, kcal/mol:	-167.76
Dipole, Da:	4.43
IP(EA), eV:	-9.86(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (1-methyl-5-oxo-3-propan-2-yl-2H-pyrrol-2-yl) carbonate

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC(=O)N(C1OC(=O)OC)C

DOS

IR

Vibrations