Geometry & MOs

Info

ID:	362101
PubChem CID:	127305783
Reduced:	O3N5C19H25 (1)
Stoich.:	A3B5C19D25 (1)
Weight, g/mol:	397.236542
ΔH_f, kcal/mol:	-87.66
Dipole, Da:	4.78
IP(EA), eV:	-9.19(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(1-benzoylpiperidine-3-carbonyl)piperidin-3-yl]-pyrrolidin-1-ylmethanone

Drug info:

PubChemData

Smile

CC1=C(C(=O)N2C(=N1)C=CN2)CC(=O)N3CCCC(C3)C(=O)N4CCCC4

DOS

IR

Vibrations