Geometry & MOs

Info

ID:	46499
PubChem CID:	10524795
Reduced:	N2O3C15H24 (1)
Stoich.:	A2B3C15D24 (1)
Weight, g/mol:	396.135508
ΔH_f, kcal/mol:	-120.32
Dipole, Da:	3.03
IP(EA), eV:	-8.39(0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 2-[1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrol-2-yl]sulfonylpyrrole-1-carboxylate

Drug info:

PubChemData

Smile

CC(C)(C)NCC(COC1=CC2=C(C=C1)NCCO2)O

DOS

IR

Vibrations