Geometry & MOs

Info

ID:	151750
PubChem CID:	56310466
Reduced:	O3N4C21H30 (1)
Stoich.:	A3B4C21D30 (1)
Weight, g/mol:	389.210327
ΔH_f, kcal/mol:	-69.17
Dipole, Da:	4.52
IP(EA), eV:	-8.61(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-pentan-3-yl-4-(quinolin-8-ylmethyl)-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Drug info:

PubChemData

Smile

CCCCC1=NC(=NO1)CN2CC(OC3=CC=CC=C32)C(=O)NC(CC)CC

DOS

IR

Vibrations