Geometry & MOs

Info

ID:	322282
PubChem CID:	126669587
Reduced:	N3O4C19H25 (1)
Stoich.:	A3B4C19D25 (1)
Weight, g/mol:	243.1987
ΔH_f, kcal/mol:	-147.51
Dipole, Da:	5.5
IP(EA), eV:	-9.3(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-benzyl-1-(3,5-dimethylcyclohex-3-en-1-yl)-N-methylmethanamine

Drug info:

PubChemData

Smile

COCC(=O)N1CC2C[C@H]3[C@@H](C1[C@@H](C2)N3CC4=CC(=CC=C4)C(=O)N)O

DOS

IR

Vibrations