Geometry & MOs

Info

ID:	148285
PubChem CID:	53787947
Reduced:	OC3H3 (6)
Stoich.:	AB3C3 (6)
Weight, g/mol:	335.236148
ΔH_f, kcal/mol:	-173.04
Dipole, Da:	3.47
IP(EA), eV:	-9.48(-1.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[5-methyl-2-(4-methylphenyl)-1H-imidazol-4-yl]methyl]adamantan-1-amine

Drug info:

PubChemData

Smile

CCC(=CC=O)C(=O)OC1=CC=C(C=C1)OC(=O)C(=CC=O)CC

DOS

IR

Vibrations