Geometry & MOs

Info

ID:	278814
PubChem CID:	103838567
Reduced:	ClN2C17H19 (1)
Stoich.:	AB2C17D19 (1)
Weight, g/mol:	267.143471
ΔH_f, kcal/mol:	70.51
Dipole, Da:	1.64
IP(EA), eV:	-9.03(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1-cyclopropylcyclopropyl)methyl]-1-[4-(difluoromethoxy)phenyl]methanamine

Drug info:

PubChemData

Smile

C1CC1C2(CC2)CNCC3=C4C(=C(C=C3)Cl)C=CC=N4

DOS

IR

Vibrations