Geometry & MOs

Info

ID:	422382
PubChem CID:	135117724
Reduced:	SN3O4C17H27 (1)
Stoich.:	AB3C4D17E27 (1)
Weight, g/mol:	287.163377
ΔH_f, kcal/mol:	-146.59
Dipole, Da:	5.84
IP(EA), eV:	-9.1(0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,2,5-trimethyl-N-(2-pyridin-3-yloxypropyl)pyrrole-3-carboxamide

Drug info:

PubChemData

Smile

CN(C)S(=O)(=O)C[C@@H]1COC[C@H]1NC(=O)CN(C)CC2=CC=CC=C2

DOS

IR

Vibrations