Geometry & MOs

Info

ID:	357854
PubChem CID:	127294697
Reduced:	ON4C9H12 (2)
Stoich.:	AB4C9D12 (2)
Weight, g/mol:	377.279075
ΔH_f, kcal/mol:	37.52
Dipole, Da:	6.14
IP(EA), eV:	-9.1(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=C(C(=NO1)C)CCNC(=O)N2CCN(CC2)C3=NC=NC4=C3C=NN4C

DOS

IR

Vibrations