Geometry & MOs

Info

ID:	367291
PubChem CID:	127324070
Reduced:	ClN3O3C17H22 (1)
Stoich.:	AB3C3D17E22 (1)
Weight, g/mol:	306.205576
ΔH_f, kcal/mol:	-87.37
Dipole, Da:	4.02
IP(EA), eV:	-8.91(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(cyclobutylmethyl)-4-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]piperazine-1-carboxamide

Drug info:

PubChemData

Smile

C1CC1N2CCC(C2)NC(=O)NCC3=CC4=C(C(=C3)Cl)OCCO4

DOS

IR

Vibrations