Geometry & MOs

Info

ID:	395783
PubChem CID:	135026523
Reduced:	NSiO4C23H35 (1)
Stoich.:	ABC4D23E35 (1)
Weight, g/mol:	326.126657
ΔH_f, kcal/mol:	-134.62
Dipole, Da:	5.98
IP(EA), eV:	-9.1(0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 2-(2-isocyano-5-methoxycarbonylphenyl)pyrrole-1-carboxylate

Drug info:

PubChemData

Smile

C[Si](C)(C)CCOC1=CCON([C@H]1[C@H]2COC(O2)CCC=C)CC3=CC=CC=C3

DOS

IR

Vibrations