Geometry & MOs

Info

ID:	85785
PubChem CID:	49879116
Reduced:	O3N4C17H22 (1)
Stoich.:	A3B4C17D22 (1)
Weight, g/mol:	370.236876
ΔH_f, kcal/mol:	-34.12
Dipole, Da:	4.29
IP(EA), eV:	-8.94(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[cyclohexyl(methyl)amino]propyl]-3,4-dihydro-1H-[1,4]oxazino[4,3-a]benzimidazole-8-carboxamide

Drug info:

PubChemData

Smile

CN1CCC(=CC1)C2=NOC(=N2)CCC(=O)NCCC3=CC=CO3

DOS

IR

Vibrations