Geometry & MOs

Info

ID:	326846
PubChem CID:	126688397
Reduced:	FN2O2C12H13 (2)
Stoich.:	AB2C2D12E13 (2)
Weight, g/mol:	502.18279
ΔH_f, kcal/mol:	-219.3
Dipole, Da:	4.84
IP(EA), eV:	-8.57(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(difluoromethyl)-N-[1-[(4-fluorooxan-4-yl)methyl]-5-(2-oxo-1,3-oxazinan-3-yl)benzimidazol-2-yl]benzamide

Drug info:

PubChemData

Smile

CC1(CCN(C(=O)O1)C2=CC3=C(C=C2)N=C(N3CCCO)NC(=O)C4=CC=CC(=C4)C(F)F)C

DOS

IR

Vibrations