Geometry & MOs

Info

ID:	70587
PubChem CID:	48413557
Reduced:	ClON4C17H25 (1)
Stoich.:	ABC4D17E25 (1)
Weight, g/mol:	381.262757
ΔH_f, kcal/mol:	-20.32
Dipole, Da:	1.59
IP(EA), eV:	-8.61(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methoxyethyl 5-[5-(diethylamino)pentan-2-ylcarbamoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate

Drug info:

PubChemData

Smile

CCN(CC)CCCC(C)NC(=O)C1=C(N=C2N1C=CC=C2)Cl

DOS

IR

Vibrations