Geometry & MOs

Info

ID:	417519
PubChem CID:	135098401
Reduced:	N2O2C10H13 (2)
Stoich.:	A2B2C10D13 (2)
Weight, g/mol:	267.150225
ΔH_f, kcal/mol:	-123.32
Dipole, Da:	9.62
IP(EA), eV:	-8.45(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-N-methyl-N-(3-pyrrolidin-1-ylbutyl)pyridin-2-amine

Drug info:

PubChemData

Smile

CC1=C(C=NN1C)NC(=O)CN2CC[C@@H]([C@@](C2)(CC3=CC=CC=C3)C(=O)O)O

DOS

IR

Vibrations