Geometry & MOs

Info

ID:	152804
PubChem CID:	56311878
Reduced:	N3O4C24H29 (1)
Stoich.:	A3B4C24D29 (1)
Weight, g/mol:	410.220557
ΔH_f, kcal/mol:	-135.06
Dipole, Da:	4.52
IP(EA), eV:	-8.45(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(5-acetyl-2-methoxyphenyl)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)CC(=O)NC3=CC=CC=C3C(=O)C

DOS

IR

Vibrations