Geometry & MOs

Info

ID:	129820
PubChem CID:	51073958
Reduced:	N3O4C15H17 (1)
Stoich.:	A3B4C15D17 (1)
Weight, g/mol:	278.199428
ΔH_f, kcal/mol:	-108.17
Dipole, Da:	4.13
IP(EA), eV:	-8.65(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

cyclohex-3-en-1-yl-[4-(oxolan-2-ylmethyl)piperazin-1-yl]methanone

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)NC(=O)C2=NN(C(=O)C=C2)CCOC)O

DOS

IR

Vibrations