Geometry & MOs

Info

ID:	370342
PubChem CID:	127338114
Reduced:	N3O3C20H31 (1)
Stoich.:	A3B3C20D31 (1)
Weight, g/mol:	360.196154
ΔH_f, kcal/mol:	-123.62
Dipole, Da:	3.23
IP(EA), eV:	-8.88(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclohex-3-en-1-yl-4-[2-(4-fluoroanilino)-2-oxoethyl]piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CC1CN(CC(O1)C)C(=O)NCC(C2=CC=C(C=C2)OC)N3CCCC3

DOS

IR

Vibrations