Geometry & MOs

Info

ID:	344132
PubChem CID:	127267308
Reduced:	O2F3N3C15H16 (1)
Stoich.:	A2B3C3D15E16 (1)
Weight, g/mol:	332.209993
ΔH_f, kcal/mol:	-175.61
Dipole, Da:	7.43
IP(EA), eV:	-8.84(-1.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(4-propan-2-yloxyphenyl)ethyl]-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[2,1-c][1,4]oxazine-3-carboxamide

Drug info:

PubChemData

Smile

CN(C)CCC1=CC=C(C=C1)NC(=O)C2=C(N=CO2)C(F)(F)F

DOS

IR

Vibrations