Geometry & MOs

Info

ID:	245619
PubChem CID:	99455624
Reduced:	F2N3O5C20H29 (1)
Stoich.:	A2B3C5D20E29 (1)
Weight, g/mol:	429.207527
ΔH_f, kcal/mol:	-306.19
Dipole, Da:	5.35
IP(EA), eV:	-8.83(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(difluoromethoxy)-N-[2-[[(2S)-2-[(2R,6R)-2,6-dimethylmorpholin-4-yl]propyl]amino]-2-oxoethyl]-3-methoxybenzamide

Drug info:

PubChemData

Smile

C[C@@H]1CN(C[C@@H](O1)C)[C@@H](C)CNC(=O)CNC(=O)C2=CC(=C(C=C2)OC(F)F)OC

DOS

IR

Vibrations