Geometry & MOs

Info

ID:	126223
PubChem CID:	50955862
Reduced:	FN4H19C21 (1)
Stoich.:	AB4C19D21 (1)
Weight, g/mol:	362.220557
ΔH_f, kcal/mol:	61.43
Dipole, Da:	7.64
IP(EA), eV:	-8.7(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[2-[(2,2-dimethyloxan-4-yl)-ethylamino]-2-oxoethoxy]phenyl]propanamide

Drug info:

PubChemData

Smile

CCN1C=NC=C1CN2C=NC(=C2C3=CC=C(C=C3)F)C4=CC=CC=C4

DOS

IR

Vibrations