Geometry & MOs

Info

ID:	131560
PubChem CID:	51227069
Reduced:	SO2N3C19H23 (1)
Stoich.:	AB2C3D19E23 (1)
Weight, g/mol:	330.137971
ΔH_f, kcal/mol:	-42.56
Dipole, Da:	2.82
IP(EA), eV:	-8.89(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(5-fluoro-2-methoxyphenyl)methyl]-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Drug info:

PubChemData

Smile

CC(C)C1=CC=C(C=C1)C(C2=CC=CS2)NCC(=O)N3CCNC3=O

DOS

IR

Vibrations