Geometry & MOs

Info

ID:	270728
PubChem CID:	103637850
Reduced:	SN4C15H24 (1)
Stoich.:	AB4C15D24 (1)
Weight, g/mol:	250.215747
ΔH_f, kcal/mol:	57.72
Dipole, Da:	3.72
IP(EA), eV:	-8.53(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-cyclopropyl-N'-ethyl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]ethane-1,2-diamine

Drug info:

PubChemData

Smile

CCN(CCNCC1=C(N=C2N1C=C(S2)C)C)C3CC3

DOS

IR

Vibrations