Geometry & MOs

Info

ID:	365353
PubChem CID:	127317752
Reduced:	N3O4C21H23 (1)
Stoich.:	A3B4C21D23 (1)
Weight, g/mol:	356.221226
ΔH_f, kcal/mol:	-135.09
Dipole, Da:	5.16
IP(EA), eV:	-8.24(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-cyclobutyl-N-[4-(pyrrolidine-1-carbonyl)phenyl]piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CC(=O)NC1=CC=C(C=C1)NC(=O)NC2=CC3=C(C=C2)OC4(O3)CCCCC4

DOS

IR

Vibrations