Geometry & MOs

Info

ID:	131654
PubChem CID:	51239139
Reduced:	FN3O3C21H24 (1)
Stoich.:	AB3C3D21E24 (1)
Weight, g/mol:	357.168856
ΔH_f, kcal/mol:	-125.08
Dipole, Da:	3.26
IP(EA), eV:	-8.52(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[(4-ethyl-2,3-dihydro-1,4-benzoxazin-2-yl)methyl-methylamino]-2-oxoethyl]furan-2-carboxamide

Drug info:

PubChemData

Smile

CCN1CC(OC2=CC=CC=C21)CN(C)C(=O)CNC(=O)C3=CC=C(C=C3)F

DOS

IR

Vibrations