Geometry & MOs

Info

ID:	310595
PubChem CID:	126583484
Reduced:	NOC21H37 (1)
Stoich.:	ABC21D37 (1)
Weight, g/mol:	362.272199
ΔH_f, kcal/mol:	-46.3
Dipole, Da:	2.06
IP(EA), eV:	-8.73(1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[3-methyl-4-[N-pentyl-C-(2-phenylethyl)carbonimidoyl]phenyl]methyl]cyclopropanamine

Drug info:

PubChemData

Smile

CCC(C)NC/C=C(\C(=C\C)\CCC(=C)OC)/C(C)(C)/C=C\C

DOS

IR

Vibrations