Geometry & MOs

Info

ID:	23973
PubChem CID:	607270
Reduced:	N4O5C21H30 (1)
Stoich.:	A4B5C21D30 (1)
Weight, g/mol:	418.22162
ΔH_f, kcal/mol:	-215.0
Dipole, Da:	2.17
IP(EA), eV:	-8.55(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 4-[(5-ethoxycarbonyl-1,2,4-trimethylpyrrol-3-yl)carbamoylamino]-1,3,5-trimethylpyrrole-2-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(C(=C(N1C)C)NC(=O)NC2=C(N(C(=C2C)C(=O)OCC)C)C)C

DOS

IR

Vibrations