Geometry & MOs

Info

ID:	305883
PubChem CID:	124972604
Reduced:	ClO2N3C34H42 (1)
Stoich.:	AB2C3D34E42 (1)
Weight, g/mol:	352.153541
ΔH_f, kcal/mol:	-48.2
Dipole, Da:	7.04
IP(EA), eV:	-8.15(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(6R)-6-(3-methoxyphenyl)-3-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-(5-methyl-1,3-oxazol-4-yl)methanone

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)OC[C@@]2(CCCN(C2)CC3=CC=C(C=C3)N4CCCC4)CC(=O)N(C)CC5=CC=CC=C5)Cl

DOS

IR

Vibrations