Geometry & MOs

Info

ID:	157819
PubChem CID:	56437466
Reduced:	O2N5C23H33 (1)
Stoich.:	A2B5C23D33 (1)
Weight, g/mol:	451.221954
ΔH_f, kcal/mol:	-48.37
Dipole, Da:	10.25
IP(EA), eV:	-8.31(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[1-[3-[5-(4-methoxyphenyl)-1,3-oxazol-2-yl]propanoyl]piperidin-4-yl]methyl]-1-methylpyrazole-4-carboxamide

Drug info:

PubChemData

Smile

CCN(C1=CC=C(C=C1)C(=O)N2CCC(CC2)CNC(=O)C3=CN(N=C3)C)C(C)C

DOS

IR

Vibrations