Geometry & MOs

Info

ID:	69330
PubChem CID:	46530712
Reduced:	O4N5C16H23 (1)
Stoich.:	A4B5C16D23 (1)
Weight, g/mol:	420.200885
ΔH_f, kcal/mol:	-169.23
Dipole, Da:	6.96
IP(EA), eV:	-9.42(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5-ethoxy-4-methoxy-2-nitrophenyl)-[4-(piperidine-1-carbonyl)piperazin-1-yl]methanone

Drug info:

PubChemData

Smile

C1CCN(CC1)C(=O)N2CCN(CC2)C(=O)CN3C=CC(=O)NC3=O

DOS

IR

Vibrations