Geometry & MOs

Info

ID:	122792
PubChem CID:	50821688
Reduced:	N2O2C19H28 (1)
Stoich.:	A2B2C19D28 (1)
Weight, g/mol:	473.222703
ΔH_f, kcal/mol:	-88.71
Dipole, Da:	7.55
IP(EA), eV:	-8.85(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-fluorophenyl)methyl]-1-[2-(4-methoxyphenyl)-5-methylpyrazolo[1,5-a]pyrimidin-7-yl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CCCCC(=O)NC1=CC=C(C=C1)C2(CC2)C(=O)NCCCC

DOS

IR

Vibrations