Geometry & MOs

Info

ID:	260383
PubChem CID:	103189535
Reduced:	N3C16H27 (1)
Stoich.:	A3B16C27 (1)
Weight, g/mol:	277.215413
ΔH_f, kcal/mol:	13.77
Dipole, Da:	2.92
IP(EA), eV:	-8.19(0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-N-(3,4-dihydro-2H-1,4-benzoxazin-2-ylmethyl)-2-N-ethyl-1-N,1-N-dimethylpropane-1,2-diamine

Drug info:

PubChemData

Smile

CCN(CC1=CC2=C(C=C1)NCC2)C(C)CN(C)C

DOS

IR

Vibrations