Geometry & MOs

Info

ID:	430485
PubChem CID:	135170549
Reduced:	NO3C9H13 (1)
Stoich.:	AB3C9D13 (1)
Weight, g/mol:	185.068808
ΔH_f, kcal/mol:	-123.28
Dipole, Da:	2.61
IP(EA), eV:	-9.86(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1,3-dimethyl-5-oxo-2H-pyrrol-2-yl) methyl carbonate

Drug info:

PubChemData

Smile

CCC1=CC(N(C1=O)C)OC(=O)C

DOS

IR

Vibrations