Geometry & MOs

Info

ID:	423561
PubChem CID:	135119743
Reduced:	N2O3C23H26 (1)
Stoich.:	A2B3C23D26 (1)
Weight, g/mol:	356.184841
ΔH_f, kcal/mol:	-87.5
Dipole, Da:	6.26
IP(EA), eV:	-9.08(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3R,4R)-3-hydroxy-1-(2-propylpyrazole-3-carbonyl)piperidin-4-yl]benzamide

Drug info:

PubChemData

Smile

CN([C@@H]1C[C@@H]2CC(=O)NC[C@@H]2C1)C(=O)C3=CC=C(C=C3)COC4=CC=CC=C4

DOS

IR

Vibrations