Geometry & MOs

Info

ID:	448881
PubChem CID:	135294227
Reduced:	N5C27H49 (1)
Stoich.:	A5B27C49 (1)
Weight, g/mol:	251.1674
ΔH_f, kcal/mol:	49.33
Dipole, Da:	2.48
IP(EA), eV:	-8.71(0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-4-(2-methyl-5-phenylphenyl)but-1-en-2-amine

Drug info:

PubChemData

Smile

CC1N(N1C(C)CC(C(=C)C)N(C)CCC(C2=CCCN=C2)NCCCCC=C)C(C)C

DOS

IR

Vibrations