Geometry & MOs

Info

ID:	180387
PubChem CID:	76626821
Reduced:	N2O5C15H18 (1)
Stoich.:	A2B5C15D18 (1)
Weight, g/mol:	490.192629
ΔH_f, kcal/mol:	-142.24
Dipole, Da:	4.28
IP(EA), eV:	-9.84(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-hydroxy-N-(4-methyl-1-oxo-3,4,4a,5,6,7,8,8a-octahydrobenzo[d]oxazin-6-yl)-3-phenyl-2-(4-thiophen-2-ylphenyl)propanamide

Drug info:

PubChemData

Smile

CC1C2CC(CCC2C(=O)ON1)NC(=O)C(=O)C3=CC=CO3

DOS

IR

Vibrations