Geometry & MOs

Info

ID:	289838
PubChem CID:	104378157
Reduced:	ClN2C13H21 (1)
Stoich.:	AB2C13D21 (1)
Weight, g/mol:	194.153147
ΔH_f, kcal/mol:	-4.04
Dipole, Da:	2.59
IP(EA), eV:	-8.99(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-cyclopropyl-N-[(2-methylpyrazol-3-yl)methyl]ethane-1,2-diamine

Drug info:

PubChemData

Smile

CC(C)NCCNCCC1=CC=C(C=C1)Cl

DOS

IR

Vibrations