Geometry & MOs

Info

ID:	354658
PubChem CID:	127287275
Reduced:	FSN4O4C16H23 (1)
Stoich.:	ABC4D4E16F23 (1)
Weight, g/mol:	390.226705
ΔH_f, kcal/mol:	-183.95
Dipole, Da:	7.0
IP(EA), eV:	-8.92(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-(2,2-dimethylpropanoyl)-2,3-dihydro-1,4-benzoxazin-6-yl]-3-[(4-methylmorpholin-2-yl)methyl]urea

Drug info:

PubChemData

Smile

CN1CCOC(C1)CNC(=O)NC2=C(C=CC(=C2)N3CCCS3(=O)=O)F

DOS

IR

Vibrations