Geometry & MOs

Info

ID:	365778
PubChem CID:	127318503
Reduced:	ON4C23H32 (1)
Stoich.:	AB4C23D32 (1)
Weight, g/mol:	350.163043
ΔH_f, kcal/mol:	-18.0
Dipole, Da:	2.74
IP(EA), eV:	-8.81(0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-oxo-N-(1-phenylcyclohexyl)-4H-1,4-benzoxazine-6-carboxamide

Drug info:

PubChemData

Smile

CN1C=CN=C1CN2CCC(CC2)C(=O)NC3(CCCCC3)C4=CC=CC=C4

DOS

IR

Vibrations