Geometry & MOs

Info

ID:	152798
PubChem CID:	56311869
Reduced:	OSN2C21H26 (1)
Stoich.:	ABC2D21E26 (1)
Weight, g/mol:	304.215078
ΔH_f, kcal/mol:	15.39
Dipole, Da:	3.65
IP(EA), eV:	-8.37(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2-methylpropyl)-N-pentan-3-yl-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Drug info:

PubChemData

Smile

CC(C1=CC=CC=C1)N(CC2CC2)CC(=O)NC3=CC(=CC=C3)SC

DOS

IR

Vibrations