Geometry & MOs

Info

ID:	362393
PubChem CID:	127307738
Reduced:	ON6C15H20 (1)
Stoich.:	AB6C15D20 (1)
Weight, g/mol:	335.232125
ΔH_f, kcal/mol:	35.2
Dipole, Da:	2.21
IP(EA), eV:	-8.91(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-methyl-1H-imidazol-5-yl)-[4-[(4-propan-2-ylmorpholin-2-yl)methyl]piperazin-1-yl]methanone

Drug info:

PubChemData

Smile

CC1=NC=C(N1)C(=O)N2CCC(CC2)N(C)C3=NN=CC=C3

DOS

IR

Vibrations