Geometry & MOs

Info

ID:	420914
PubChem CID:	135115033
Reduced:	O3N4C21H30 (1)
Stoich.:	A3B4C21D30 (1)
Weight, g/mol:	302.210661
ΔH_f, kcal/mol:	-115.3
Dipole, Da:	2.48
IP(EA), eV:	-8.71(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-cyclohexyl-1,2-oxazol-5-yl)-N-[(1-ethylimidazol-2-yl)methyl]-N-methylmethanamine

Drug info:

PubChemData

Smile

CN1CCC[C@]2([C@H]1CN(CC2)C3=NC=CC(=C3)C(=O)N4CCCCC4)C(=O)O

DOS

IR

Vibrations