Geometry & MOs

Info

ID:	152534
PubChem CID:	56311488
Reduced:	N3O3C25H31 (1)
Stoich.:	A3B3C25D31 (1)
Weight, g/mol:	435.215806
ΔH_f, kcal/mol:	-96.07
Dipole, Da:	3.22
IP(EA), eV:	-8.38(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[2-(4-methoxyphenyl)-1,3-oxazol-4-yl]methyl]-N-pentan-3-yl-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Drug info:

PubChemData

Smile

CCC(CC)NC(=O)C1CN(C2=CC=CC=C2O1)CCC(=O)N3CCC4=CC=CC=C43

DOS

IR

Vibrations