Geometry & MOs

Info

ID:	255475
PubChem CID:	103132353
Reduced:	N3C10H17 (1)
Stoich.:	A3B10C17 (1)
Weight, g/mol:	207.173548
ΔH_f, kcal/mol:	42.5
Dipole, Da:	3.04
IP(EA), eV:	-8.68(0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-N-tert-butyl-4-(1-methylpyrazol-3-yl)but-3-en-1-amine

Drug info:

PubChemData

Smile

CCNCC/C=C/C1=NN(C=C1)C

DOS

IR

Vibrations