Geometry & MOs

Info

ID:	422424
PubChem CID:	135117814
Reduced:	N2O2C10H13 (2)
Stoich.:	A2B2C10D13 (2)
Weight, g/mol:	250.10659
ΔH_f, kcal/mol:	-104.72
Dipole, Da:	5.86
IP(EA), eV:	-8.31(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[5-(methoxymethyl)-1,2,4-oxadiazol-3-yl]methyl]-1-methylpyrrole-2-carboxamide

Drug info:

PubChemData

Smile

CN(C)[C@H]1CN(C[C@@H]1O)C2=C(C=CC=N2)C(=O)NC3=C(C=C(C=C3)OC)OC

DOS

IR

Vibrations