Geometry & MOs

Info

ID:	255870
PubChem CID:	103135309
Reduced:	N3C11H21 (1)
Stoich.:	A3B11C21 (1)
Weight, g/mol:	277.251798
ΔH_f, kcal/mol:	21.04
Dipole, Da:	2.19
IP(EA), eV:	-8.66(1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-butylcyclohexyl)-(1-methylpyrazol-3-yl)methyl]ethanamine

Drug info:

PubChemData

Smile

CC(C)C(C)C(C1=NN(C=C1)C)NC

DOS

IR

Vibrations