Geometry & MOs

Info

ID:	253313
PubChem CID:	103117652
Reduced:	N2C8H13 (2)
Stoich.:	A2B8C13 (2)
Weight, g/mol:	226.179361
ΔH_f, kcal/mol:	35.21
Dipole, Da:	2.62
IP(EA), eV:	-8.47(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-N-(2-methoxyethyl)-2-N-[(1-methylpyrazol-3-yl)methyl]propane-1,2-diamine

Drug info:

PubChemData

Smile

CC(C)CNCC(C)NCC1=NN(C2=CC=CC=C21)C

DOS

IR

Vibrations