Geometry & MOs

Info

ID:	344608
PubChem CID:	127268192
Reduced:	O3N4C20H32 (1)
Stoich.:	A3B4C20D32 (1)
Weight, g/mol:	317.185175
ΔH_f, kcal/mol:	-115.19
Dipole, Da:	7.0
IP(EA), eV:	-9.18(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3,5-dimethyl-1,2-oxazol-4-yl)-1-[4-[(1-methylimidazol-2-yl)methyl]piperazin-1-yl]ethanone

Drug info:

PubChemData

Smile

CC1CCCC(C1)NC(=O)CN2CCN(CC2)C(=O)CC3=C(ON=C3C)C

DOS

IR

Vibrations