Geometry & MOs

Info

ID:	202136
PubChem CID:	79634109
Reduced:	O2N3C16H31 (1)
Stoich.:	A2B3C16D31 (1)
Weight, g/mol:	297.241627
ΔH_f, kcal/mol:	-112.0
Dipole, Da:	3.95
IP(EA), eV:	-8.72(0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 1-amino-3-[(1-ethylpyrrolidin-2-yl)methyl-methylamino]cyclohexane-1-carboxylate

Drug info:

PubChemData

Smile

CCNC1(CCCC(C1)N(C)CC2CCCN2C)C(=O)O

DOS

IR

Vibrations