Geometry & MOs

Info

ID:	333597
PubChem CID:	127252149
Reduced:	ClO2N3C19H24 (1)
Stoich.:	AB2C3D19E24 (1)
Weight, g/mol:	410.231791
ΔH_f, kcal/mol:	-34.41
Dipole, Da:	3.28
IP(EA), eV:	-8.59(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-1-(1-methylpiperidine-4-carbonyl)-3-[(3-phenyl-1,2-oxazol-5-yl)methyl]pyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)C1=NOC(=C1)CC2(CCN(C2)C3=CC=C(C=C3)Cl)C(=O)NC

DOS

IR

Vibrations