Geometry & MOs

Info

ID:	416712
PubChem CID:	135090162
Reduced:	N3O3C16H25 (1)
Stoich.:	A3B3C16D25 (1)
Weight, g/mol:	287.145619
ΔH_f, kcal/mol:	-131.01
Dipole, Da:	7.37
IP(EA), eV:	-9.7(0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3-cyclopropylimidazol-4-yl)methyl]-N-methyl-1-(3-methylsulfanylphenyl)methanamine

Drug info:

PubChemData

Smile

C=CCCC(=O)N1CCCN(CC1)C(=O)C2CCC(=O)NC2

DOS

IR

Vibrations