Geometry & MOs

Info

ID:	129671
PubChem CID:	51073513
Reduced:	NOC6H11 (3)
Stoich.:	ABC6D11 (3)
Weight, g/mol:	282.136828
ΔH_f, kcal/mol:	-158.14
Dipole, Da:	3.73
IP(EA), eV:	-8.66(0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,3-benzoxazol-2-ylmethyl)-1-(3-methoxyphenyl)-N-methylmethanamine

Drug info:

PubChemData

Smile

C1CCC(CC1)(CNC(=O)CN2CCCC(C2)O)N3CCOCC3

DOS

IR

Vibrations