Geometry & MOs

Info

ID:	244649
PubChem CID:	99376202
Reduced:	N2O3C22H34 (1)
Stoich.:	A2B3C22D34 (1)
Weight, g/mol:	382.200491
ΔH_f, kcal/mol:	-158.33
Dipole, Da:	5.09
IP(EA), eV:	-8.88(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3R)-1-[2-(6-oxo-3-phenylpyridazin-1-yl)acetyl]piperidin-3-yl]butanamide

Drug info:

PubChemData

Smile

CCCC(=O)N[C@H]1CCCN(C1)C(=O)[C@@H](C)OC2=CC(=C(C=C2)C(C)C)C

DOS

IR

Vibrations