Geometry & MOs

Info

ID:	255255
PubChem CID:	103130939
Reduced:	N3C4H6 (2)
Stoich.:	A3B4C6 (2)
Weight, g/mol:	235.204848
ΔH_f, kcal/mol:	94.53
Dipole, Da:	5.65
IP(EA), eV:	-9.39(0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1-methylpyrazol-3-yl)-(4-propylcyclohexyl)methanamine

Drug info:

PubChemData

Smile

CNC(C1=NN(C=C1)C)C2=NC=NN2

DOS

IR

Vibrations