Geometry & MOs

Info

ID:	366265
PubChem CID:	127319722
Reduced:	SO2N7C17H25 (1)
Stoich.:	AB2C7D17E25 (1)
Weight, g/mol:	374.155432
ΔH_f, kcal/mol:	-12.97
Dipole, Da:	4.53
IP(EA), eV:	-9.23(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(2,4-difluorobenzoyl)piperidin-4-yl]-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone

Drug info:

PubChemData

Smile

CC1=C(C(=NN1C)C)C(C)C(=O)N2CCN(CC2)CC(=O)NC3=NN=CS3

DOS

IR

Vibrations