Geometry & MOs

Info

ID:	151185
PubChem CID:	53790885
Reduced:	O5N6C54H107 (1)
Stoich.:	A5B6C54D107 (1)
Weight, g/mol:	330.209599
ΔH_f, kcal/mol:	-336.33
Dipole, Da:	9.86
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.755394
Charge, e:	0

Chem-info

IUPAC name:

4-[amino-bis(4-methylphenyl)methyl]-N,N-dimethylaniline

Drug info:

PubChemData

Smile

CCCCCCCCC=CCCCCCCCC(=O)OCC(C[N+](C)(C)CCNC(=O)NCCCNCCCCNCCCN)OC(=O)CCCCCCCC=CCCCCCCCC

DOS

IR

Vibrations