Geometry & MOs

Info

ID:	290071
PubChem CID:	104406588
Reduced:	N3O4C12H21 (1)
Stoich.:	A3B4C12D21 (1)
Weight, g/mol:	211.148476
ΔH_f, kcal/mol:	-181.4
Dipole, Da:	1.02
IP(EA), eV:	-9.37(0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-N-[(3-fluoropyridin-4-yl)methyl]-1-N,1-N-dimethylpropane-1,2-diamine

Drug info:

PubChemData

Smile

CC(C(=O)N1CCOCC1)NC(=O)C2(CCOC2)N

DOS

IR

Vibrations