Geometry & MOs

Info

ID:	423573
PubChem CID:	135119760
Reduced:	FN4O4C18H23 (1)
Stoich.:	AB4C4D18E23 (1)
Weight, g/mol:	289.179027
ΔH_f, kcal/mol:	-118.51
Dipole, Da:	4.88
IP(EA), eV:	-8.86(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[3-(2-methylpropyl)-1,2-oxazol-5-yl]methyl]-1-propan-2-ylpyrrole-2-carboxamide

Drug info:

PubChemData

Smile

CN(C)C1=NOC(=C1C(=O)N2CCOC(C2)CN)C3=CC(=C(C=C3)F)OC

DOS

IR

Vibrations