Geometry & MOs

Info

ID:	352659
PubChem CID:	127283748
Reduced:	O2N6C19H30 (1)
Stoich.:	A2B6C19D30 (1)
Weight, g/mol:	376.283826
ΔH_f, kcal/mol:	-40.03
Dipole, Da:	2.79
IP(EA), eV:	-8.37(0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,3-dimethylcyclohexyl)-2-[4-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]piperazin-1-yl]propanamide

Drug info:

PubChemData

Smile

CC1=C(OC(=N1)CN2CCN(CC2)C(C)C(=O)NC3=C(N(N=C3C)C)C)C

DOS

IR

Vibrations