Geometry & MOs

Info

ID:	255330
PubChem CID:	103131438
Reduced:	ON3C16H29 (1)
Stoich.:	AB3C16D29 (1)
Weight, g/mol:	293.246713
ΔH_f, kcal/mol:	-38.65
Dipole, Da:	2.44
IP(EA), eV:	-8.44(1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1-ethoxy-4-methylcyclohexyl)-(1-methylpyrazol-3-yl)methyl]propan-1-amine

Drug info:

PubChemData

Smile

CCNC(C1=NN(C=C1)C)C2(CCC(CC2)C)OCC

DOS

IR

Vibrations