Geometry & MOs

Info

ID:	407325
PubChem CID:	135079828
Reduced:	NSiO2C12H21 (1)
Stoich.:	ABC2D12E21 (1)
Weight, g/mol:	303.110673
ΔH_f, kcal/mol:	-105.3
Dipole, Da:	6.07
IP(EA), eV:	-9.22(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 4-(3,4-dimethoxyphenyl)-5-formyl-1H-pyrrole-2-carboxylate

Drug info:

PubChemData

Smile

CC(=O)C1=CN(C=C1)COCC[Si](C)(C)C

DOS

IR

Vibrations